Sclareol (CAS 515-03-7) — formula C20H36O2, molecular weight 308.5; category organic chemicals.
| CAS Number | 515-03-7 |
|---|---|
| Molecular Formula | C20H36O2 |
| Molecular Weight | 308.5 |
| LogP | 4.9 |
| Applications | Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Intermediate, Consumer Uses: Intermediate, Household Products: Cosmetics product ingredient: 1-Naphthalenepropanol, a-ethenyldecahydro- 2-hydroxy-a, 2, 5, 8a-pentamethyl-, [1R-[1a(R), 2ß, 4aß, 8aa]]- (Sclareol, [1R-(1alpha)]-alpha-Ethenyldecahydro-2-hydroxy-a, 8a-pentamethyl-1-naphthalenepropanol), Sclareol is a fragrance allergen. Fragrance allergens are hazardous only to individuals who suffer from fragrance allergies. The Cosmetic Fragrance and Flavor Ingredient Right to Know Act of 2020 requires fragrance allergens included in Annex III of the EU Cosmetics Regulation No. 1223, 2009 be reported to the California Department of Public Health. Fragrance allergens are only required to be reported if present in a rinse-off cosmetic product at a concentration at or above 0.01 percent (100 parts per million) or in a leave-on cosmetic product at a concentration at or above 0.001 percent (10 parts per million)., Reason for Listing: Listed as Persistent, Bioaccumulative, and Inherently Toxic to the environment by the Canadian Environmental Protection Act Environmental Registry Domestic Substances List., Potential Health Impacts: Bioaccumulation, Environmental Persistence, and Undefined Toxicity, For more information, you can visit the fragrance allergens webpage on the California Safe Cosmetics Program website:, https:, www.cdph.ca.gov, Programs, CCDPHP, DEODC, OHB, CSCP, Pages, FragranceAllergens.aspx, Product count: 227, IFRA Fragrance Standards: Sclareol, Labd-14-ene-8, 13-diol, 1-Naphthalenepropanol, decahydro-alpha-ethenyl-2-hydroxy- alpha, 8apentamethyl-, (1R-(1-alpha(R*), 2-beta, 4a-beta, 8a-alpha))-, IFRA_STD_183.pdf, 39, IFRA 51st Amendment - Guidance for the use of IFRA Standards, Specification: This material should be used only if it meets the criteria stated in the Standard, DERMAL SENSITIZATION, 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., Sclareol used as a fragrance ingredient should have a minimum purity of 98%., U.S. Production: 2023: 293, 265 lb, 2022: 550, 000 - <1, 000, 000 lb, 2021: 250, 000 - <550, 2020: 250, General Manufacturing Information: All Other Basic Organic Chemical Manufacturing, .alpha.-ethenyldecahydro-2-hydroxy-.alpha., (.alpha.R, 1R, 2R, 4aS, 8aS)-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Intermediate, Consumer Uses: Intermediate, Household Products: Cosmetics product ingredient: 1-Naphthalenepropanol, a-ethenyldecahydro- 2-hydroxy-a, 2, 5, 8a-pentamethyl-, [1R-[1a(R), 2ß, 4aß, 8aa]]- (Sclareol, [1R-(1alpha)]-alpha-Ethenyldecahydro-2-hydroxy-a, 8a-pentamethyl-1-naphthalenepropanol), Sclareol is a fragrance allergen. Fragrance allergens are hazardous only to individuals who suffer from fragrance allergies. The Cosmetic Fragrance and Flavor Ingredient Right to Know Act of 2020 requires fragrance allergens included in Annex III of the EU Cosmetics Regulation No. 1223, 2009 be reported to the California Department of Public Health. Fragrance allergens are only required to be reported if present in a rinse-off cosmetic product at a concentration at or above 0.01 percent (100 parts per million) or in a leave-on cosmetic product at a concentration at or above 0.001 percent (10 parts per million)., Reason for Listing: Listed as Persistent, Bioaccumulative, and Inherently Toxic to the environment by the Canadian Environmental Protection Act Environmental Registry Domestic Substances List., Potential Health Impacts: Bioaccumulation, Environmental Persistence, and Undefined Toxicity, For more information, you can visit the fragrance allergens webpage on the California Safe Cosmetics Program website:, https:, www.cdph.ca.gov, Programs, CCDPHP, DEODC, OHB, CSCP, Pages, FragranceAllergens.aspx, Product count: 227, IFRA Fragrance Standards: Sclareol, Labd-14-ene-8, 13-diol, 1-Naphthalenepropanol, decahydro-alpha-ethenyl-2-hydroxy- alpha, 8apentamethyl-, (1R-(1-alpha(R*), 2-beta, 4a-beta, 8a-alpha))-, IFRA_STD_183.pdf, 39, IFRA 51st Amendment - Guidance for the use of IFRA Standards, Specification: This material should be used only if it meets the criteria stated in the Standard, DERMAL SENSITIZATION, 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., Sclareol used as a fragrance ingredient should have a minimum purity of 98%., U.S. Production: 2023: 293, 265 lb, 2022: 550, 000 - <1, 000, 000 lb, 2021: 250, 000 - <550, 2020: 250, General Manufacturing Information: All Other Basic Organic Chemical Manufacturing, .alpha.-ethenyldecahydro-2-hydroxy-.alpha., (.alpha.R, 1R, 2R, 4aS, 8aS)-: ACTIVE.
Sclareol is a carbon-based organic compound with CAS registry number 515-03-7 and molecular formula C20H36O2 (molecular weight 308.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 515-03-7
Its molecular formula C20H36O2 comprises 20 C, 36 H, 2 O atoms.
Also known as: Sclareol · 香紫苏醇
Category: organic chemicals
The CAS registry number of Sclareol is 515-03-7.
Molecular formula C20H36O2, molecular weight 308.5.
It is also registered under: Sclareol, 香紫苏醇.
Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Intermediate, Consumer Uses: Intermediate, Household Products: Cosmetics product ingredient: 1-Naphthalenepropanol, a-ethenyldecahydro- 2-hydroxy-a, 2, 5, 8a-pentamethyl-, [1R-[1a(R), 2ß, 4aß, 8aa]]- (Sclareol, [1R-(1alpha)]-alpha-Ethenyldecahydro-2-hydroxy-a, 8a-pentamethyl-1-naphthalenepropanol), Sclareol is a fragrance allergen. Fragrance allergens are hazardous only to individuals who suffer from fragrance allergies. The Cosmetic Fragrance and Flavor Ingredient Right to Know Act of 2020 requires fragrance allergens included in Annex III of the EU Cosmetics Regulation No. 1223, 2009 be reported to the California Department of Public Health. Fragrance allergens are only required to be reported if present in a rinse-off cosmetic product at a concentration at or above 0.01 percent (100 parts per million) or in a leave-on cosmetic product at a concentration at or above 0.001 percent (10 parts per million)., Reason for Listing: Listed as Persistent, Bioaccumulative, and Inherently Toxic to the environment by the Canadian Environmental Protection Act Environmental Registry Domestic Substances List., Potential Health Impacts: Bioaccumulation, Environmental Persistence, and Undefined Toxicity, For more information, you can visit the fragrance allergens webpage on the California Safe Cosmetics Program website:, https:, www.cdph.ca.gov, Programs, CCDPHP, DEODC, OHB, CSCP, Pages, FragranceAllergens.aspx, Product count: 227, IFRA Fragrance Standards: Sclareol, Labd-14-ene-8, 13-diol, 1-Naphthalenepropanol, decahydro-alpha-ethenyl-2-hydroxy- alpha, 8apentamethyl-, (1R-(1-alpha(R*), 2-beta, 4a-beta, 8a-alpha))-, IFRA_STD_183.pdf, 39, IFRA 51st Amendment - Guidance for the use of IFRA Standards, Specification: This material should be used only if it meets the criteria stated in the Standard, DERMAL SENSITIZATION, 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., Sclareol used as a fragrance ingredient should have a minimum purity of 98%., U.S. Production: 2023: 293, 265 lb, 2022: 550, 000 - <1, 000, 000 lb, 2021: 250, 000 - <550, 2020: 250, General Manufacturing Information: All Other Basic Organic Chemical Manufacturing, .alpha.-ethenyldecahydro-2-hydroxy-.alpha., (.alpha.R, 1R, 2R, 4aS, 8aS)-: ACTIVE.
Category: Organic Chemicals.
Independent reference data for Sclareol (CAS 515-03-7), compiled from public chemistry databases.
| CAS Registry Number | 515-03-7 |
|---|---|
| PubChem CID | 163263 |
| Molecular formula | C20H36O2 |
| IUPAC name | (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol |
| UNII (FDA) | B607NP0Q8Y |
| FEMA number | 4502 |
| JECFA number | 2029 |
| Molecular Weight | 308.5 |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 308.271530387 |
| Monoisotopic Mass | 308.271530387 |
| Topological Polar Surface Area | 40.5 |
| Heavy Atom Count | 22 |
Sclareol; 515-03-7; labd-14-ene-8,13-diol; DTXSID0047111; (13R)-Labd-14-ene-8,13-diol; (-)-SCLAREOL; B607NP0Q8Y; Labd-14-ene-8,13-diol, (13R)-; CHEBI:9053; DTXCID8027111; FEMA NO. 4502; 1-Naphthalenepropanol, alpha-ethenyldecahydro-2-hydroxy-alpha,2,5,5,8a-pentamethyl-, (alphaR,1R,2R,4aS,8aS)-; labd-14-ene-8alpha, 13beta-diol; RefChem:49009; 208-194-0; (1R,2R,4aS,8aS)-1-((R)-3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral (â)-SCLAREOL |
|---|---|
| GHS notification summary | 99.2% (131 / 132) |
| GHS notification summary | 99.2% (131 / 132) |
|---|
This chemical does not meet GHS hazard criteria for 99.2% (131 of 132) of all reports.
Reported as not meeting GHS hazard criteria by 131 of 132 companies (only 0.8% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Sclareol · CAS 515-03-7 · C20H36O2. UNII B607NP0Q8Y.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 香紫苏醇