百合醛（CAS 80-54-6）：分子式 C14H20O、分子量 204.31。
| CAS号 | 80-54-6 |
|---|---|
| 分子式 | C14H20O |
| 分子量 | 204.31 |
| LogP | 3.9 |
| 应用领域 | Use Classification: Fragrance Ingredients、Cosmetics -> Masking、Environmental transformation -> Pesticide transformation products (metabolite、successor)、Industry Uses: Fragrance、Consumer Uses: Fragrance、Not Known or Reasonably Ascertainable、Household Products: Cosmetics product ingredient: 2-(4-tert-Butylbenzyl)propionaldehyde (Lilial、BUTYLPHENYL METHYLPROPIONAL)、Source: Butylphenyl methylpropional (Lilial) is a synthetic chemical that has not been found in nature. It has a strong floral odor and is mainly used as a fragrance in a variety of consumer products like cleaning agents、fine fragrances、cosmetics、and air fresheners.、Potential Health Impact: Lilial acts as allergen and may cause skin irritation for people who are allergic. Lilial is toxic for reproduction. It was banned from use in cosmetics in the European Union in 2022.、Product count: 2296、Information on 377 consumer products that contain Butylphenyl Methylpropional in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Inside the Home、• Personal Care、• Pesticides、• Pet Care、Information on 2 consumer products that contain Butylphenyl methylpropional in the following categories is provided:、IFRA Fragrance Standards: p-tert-Butyl-α-methylhydrocinnamic aldehyde (p-BMHCA)、Benzenepropanal、4-(1、1-dimethylethyl)-alpha-methyl-、p-t-Bucinal、2-(4-tert-Butylbenzyl)propionaldehyde、p-t-Butyl-alpha-methylhydrocinnamaldehyde、Butylphenyl methylpropional、alpha-Methyl-Ã-(p-t-butylphenyl)propionaldehyde、Lilestralis (commercial name)、Lilial (commercial name)、Lysmeral (commercial name)、IFRA_STD_015.pdf、49、IFRA 51st Amendment - Guidance for the use of IFRA Standards、Restriction: This material should be used only in the limited quantity as stated in the Standard_Prohibition: This material should not be used as a fragrance ingredient、DERMAL SENSITIZATION AND SYSTEMIC TOXICITY、Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6、materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards.、p-tert-Butyl-α-methylhydrocinnamic aldehyde (p-BMHCA) should not be used for any finished product application included under IFRA Categories 1 and 6 (lipsticks and oral care products).、Restriction Limits in the Finished Product (%): 0.0 (Prohibited) [Products applied to the lips]、0.09 [Products applied to the axillae]、0.04 [Products applied to the face、body using fingertips]、1.4 [Products related to fine fragrances]、0.06 [Products applied to the body using the hands (palms)、primarily leave-on (Body lotion)]、0.05 [Products applied to the face using the hands (palms)、primarily leave-on (Face moisturizer)]、0.05 [Products applied to the hands using the hands (palms)、primarily leave-on (Hand cream)]、0.017 [Products applied to babies using the hands (palms)、primarily leave-on (Baby cream、oil、talc)]、0.0 (Prohibited) [Products with oral and lip exposure]、0.04 [Rinse-off products applied to the hair with some hand contact]、0.04 [Leave-on products applied to the hair with some hand contact]、0.017 [Products with significant anogenital exposure (tampon)]、0.1 [Products with body and hand exposure、primarily rinse off]、0.1 [Household care products with mostly hand contact (excluding aerosol、spray products)]、0.63 [Household care products with mostly hand contact (household aerosol、0.017 [Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure]、0.017 [Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure]、16 [Other air care products not intended for direct skin contact、minimal or insignificant transfer to skin]、U.S. Production: 2023: 1、000、000 - <2、500、000 lb、2022: 2、000 - <4、2021: 4、000 - <5、2020: 5、000 - <7、General Manufacturing Information: Plastics Material and Resin Manufacturing、All Other Chemical Product and Preparation Manufacturing、Miscellaneous Manufacturing、Soap、Cleaning Compound、and Toilet Preparation Manufacturing、1-dimethylethyl)-.alpha.-methyl-: ACTIVE |
登记用途：Use Classification: Fragrance Ingredients、Cosmetics -> Masking、Environmental transformation -> Pesticide transformation products (metabolite、successor)、Industry Uses: Fragrance、Consumer Uses: Fragrance、Not Known or Reasonably Ascertainable、Household Products: Cosmetics product ingredient: 2-(4-tert-Butylbenzyl)propionaldehyde (Lilial、BUTYLPHENYL METHYLPROPIONAL)、Source: Butylphenyl methylpropional (Lilial) is a synthetic chemical that has not been found in nature. It has a strong floral odor and is mainly used as a fragrance in a variety of consumer products like cleaning agents、fine fragrances、cosmetics、and air fresheners.、Potential Health Impact: Lilial acts as allergen and may cause skin irritation for people who are allergic. Lilial is toxic for reproduction. It was banned from use in cosmetics in the European Union in 2022.、Product count: 2296、Information on 377 consumer products that contain Butylphenyl Methylpropional in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Inside the Home、• Personal Care、• Pesticides、• Pet Care、Information on 2 consumer products that contain Butylphenyl methylpropional in the following categories is provided:、IFRA Fragrance Standards: p-tert-Butyl-α-methylhydrocinnamic aldehyde (p-BMHCA)、Benzenepropanal、4-(1、1-dimethylethyl)-alpha-methyl-、p-t-Bucinal、2-(4-tert-Butylbenzyl)propionaldehyde、p-t-Butyl-alpha-methylhydrocinnamaldehyde、Butylphenyl methylpropional、alpha-Methyl-Ã-(p-t-butylphenyl)propionaldehyde、Lilestralis (commercial name)、Lilial (commercial name)、Lysmeral (commercial name)、IFRA_STD_015.pdf、49、IFRA 51st Amendment - Guidance for the use of IFRA Standards、Restriction: This material should be used only in the limited quantity as stated in the Standard_Prohibition: This material should not be used as a fragrance ingredient、DERMAL SENSITIZATION AND SYSTEMIC TOXICITY、Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6、materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards.、p-tert-Butyl-α-methylhydrocinnamic aldehyde (p-BMHCA) should not be used for any finished product application included under IFRA Categories 1 and 6 (lipsticks and oral care products).、Restriction Limits in the Finished Product (%): 0.0 (Prohibited) [Products applied to the lips]、0.09 [Products applied to the axillae]、0.04 [Products applied to the face、body using fingertips]、1.4 [Products related to fine fragrances]、0.06 [Products applied to the body using the hands (palms)、primarily leave-on (Body lotion)]、0.05 [Products applied to the face using the hands (palms)、primarily leave-on (Face moisturizer)]、0.05 [Products applied to the hands using the hands (palms)、primarily leave-on (Hand cream)]、0.017 [Products applied to babies using the hands (palms)、primarily leave-on (Baby cream、oil、talc)]、0.0 (Prohibited) [Products with oral and lip exposure]、0.04 [Rinse-off products applied to the hair with some hand contact]、0.04 [Leave-on products applied to the hair with some hand contact]、0.017 [Products with significant anogenital exposure (tampon)]、0.1 [Products with body and hand exposure、primarily rinse off]、0.1 [Household care products with mostly hand contact (excluding aerosol、spray products)]、0.63 [Household care products with mostly hand contact (household aerosol、0.017 [Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure]、0.017 [Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure]、16 [Other air care products not intended for direct skin contact、minimal or insignificant transfer to skin]、U.S. Production: 2023: 1、000、000 - <2、500、000 lb、2022: 2、000 - <4、2021: 4、000 - <5、2020: 5、000 - <7、General Manufacturing Information: Plastics Material and Resin Manufacturing、All Other Chemical Product and Preparation Manufacturing、Miscellaneous Manufacturing、Soap、Cleaning Compound、and Toilet Preparation Manufacturing、1-dimethylethyl)-.alpha.-methyl-: ACTIVE。
百合醛 是一种化工化合物，登记 CAS 号为 80-54-6，分子式 C14H20O（分子量 204.31）。
登记 CAS 号：80-54-6
其分子式 C14H20O 由 14 个碳、20 个氢、1 个氧 组成。
别名/同义词：百合醛 · Lilialdehyde
百合醛 的 CAS 登记号为 80-54-6。
分子式 C14H20O，分子量 204.31。
别名/同义词：百合醛、Lilialdehyde。
登记用途：Use Classification: Fragrance Ingredients、Cosmetics -> Masking、Environmental transformation -> Pesticide transformation products (metabolite、successor)、Industry Uses: Fragrance、Consumer Uses: Fragrance、Not Known or Reasonably Ascertainable、Household Products: Cosmetics product ingredient: 2-(4-tert-Butylbenzyl)propionaldehyde (Lilial、BUTYLPHENYL METHYLPROPIONAL)、Source: Butylphenyl methylpropional (Lilial) is a synthetic chemical that has not been found in nature. It has a strong floral odor and is mainly used as a fragrance in a variety of consumer products like cleaning agents、fine fragrances、cosmetics、and air fresheners.、Potential Health Impact: Lilial acts as allergen and may cause skin irritation for people who are allergic. Lilial is toxic for reproduction. It was banned from use in cosmetics in the European Union in 2022.、Product count: 2296、Information on 377 consumer products that contain Butylphenyl Methylpropional in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Inside the Home、• Personal Care、• Pesticides、• Pet Care、Information on 2 consumer products that contain Butylphenyl methylpropional in the following categories is provided:、IFRA Fragrance Standards: p-tert-Butyl-α-methylhydrocinnamic aldehyde (p-BMHCA)、Benzenepropanal、4-(1、1-dimethylethyl)-alpha-methyl-、p-t-Bucinal、2-(4-tert-Butylbenzyl)propionaldehyde、p-t-Butyl-alpha-methylhydrocinnamaldehyde、Butylphenyl methylpropional、alpha-Methyl-Ã-(p-t-butylphenyl)propionaldehyde、Lilestralis (commercial name)、Lilial (commercial name)、Lysmeral (commercial name)、IFRA_STD_015.pdf、49、IFRA 51st Amendment - Guidance for the use of IFRA Standards、Restriction: This material should be used only in the limited quantity as stated in the Standard_Prohibition: This material should not be used as a fragrance ingredient、DERMAL SENSITIZATION AND SYSTEMIC TOXICITY、Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6、materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards.、p-tert-Butyl-α-methylhydrocinnamic aldehyde (p-BMHCA) should not be used for any finished product application included under IFRA Categories 1 and 6 (lipsticks and oral care products).、Restriction Limits in the Finished Product (%): 0.0 (Prohibited) [Products applied to the lips]、0.09 [Products applied to the axillae]、0.04 [Products applied to the face、body using fingertips]、1.4 [Products related to fine fragrances]、0.06 [Products applied to the body using the hands (palms)、primarily leave-on (Body lotion)]、0.05 [Products applied to the face using the hands (palms)、primarily leave-on (Face moisturizer)]、0.05 [Products applied to the hands using the hands (palms)、primarily leave-on (Hand cream)]、0.017 [Products applied to babies using the hands (palms)、primarily leave-on (Baby cream、oil、talc)]、0.0 (Prohibited) [Products with oral and lip exposure]、0.04 [Rinse-off products applied to the hair with some hand contact]、0.04 [Leave-on products applied to the hair with some hand contact]、0.017 [Products with significant anogenital exposure (tampon)]、0.1 [Products with body and hand exposure、primarily rinse off]、0.1 [Household care products with mostly hand contact (excluding aerosol、spray products)]、0.63 [Household care products with mostly hand contact (household aerosol、0.017 [Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure]、0.017 [Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure]、16 [Other air care products not intended for direct skin contact、minimal or insignificant transfer to skin]、U.S. Production: 2023: 1、000、000 - <2、500、000 lb、2022: 2、000 - <4、2021: 4、000 - <5、2020: 5、000 - <7、General Manufacturing Information: Plastics Material and Resin Manufacturing、All Other Chemical Product and Preparation Manufacturing、Miscellaneous Manufacturing、Soap、Cleaning Compound、and Toilet Preparation Manufacturing、1-dimethylethyl)-.alpha.-methyl-: ACTIVE。
百合醛（CAS 80-54-6）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 80-54-6 |
|---|---|
| PubChem CID | 228987 |
| Molecular formula | C14H20O |
| IUPAC name | 3-(4-tert-butylphenyl)-2-methylpropanal |
| UNII (FDA) | T7540GJV69 |
| Molecular Weight | 204.31 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 204.151415257 |
| Monoisotopic Mass | 204.151415257 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 15 |
80-54-6; Lilial; lily aldehyde; 2-(4-tert-Butylbenzyl)propionaldehyde; Butylphenyl methylpropional; DTXSID9026500; 4-tert-butyl-alpha-methylhydrocinnamaldehyde; Benzenepropanal, 4-(1,1-dimethylethyl)-alpha-methyl-; T7540GJV69; p-tert-Butyl-alpha-methylhydrocinnamic aldehyde; NSC-22275; DTXCID606500; BETA-LILIAL; RefChem:153446; 201-289-8; 3-(4-(tert-Butyl)phenyl)-2-methylpropanal
| Regulatory & Food Contact | CIR / INCI: Cosmetics ingredient -> Base; Flavor; Fragrance; Opacifying Agent; Other (Specify) |
|---|
| Reported hazard statements | H302 (98.7%), H315 (90.9%), H317 (99.6%), H361 (84.9%), H411 (84.2%), H412 (14%), H227, H320 |
|---|
H360Fd: May damage fertility; Suspected of damaging the unborn child [Danger Reproductive toxicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
Lilialdehyde · CAS 80-54-6 · C14H20O. UNII T7540GJV69.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: Lilialdehyde