2,6-Dimethyl-5-heptenal (CAS 106-72-9) — formula C9H16O, molecular weight 140.12 g/mol.
| CAS Number | 106-72-9 |
|---|---|
| Molecular Formula | C9H16O |
| Molecular Weight | 140.12 g/mol |
| Boiling Point | 116-124 °C (100 mm Hg) |
| LogP | 2.5 |
| Applications | Uses: Used as flavoring agent or adjuvant, [FDA], Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Other, Fragrance, Consumer Uses: Fragrance, Other, Household Products: Information on 83 consumer products that contain Dimethyl Heptenal in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Inside the Home, • Personal Care, U.S. Production: 2023: 8, 500, 000 - <10, 000, 000 lb, 2022: 8, 2021: 8, 2020: 8, General Manufacturing Information: Soap, Cleaning Compound, and Toilet Preparation Manufacturing, All Other Chemical Product and Preparation Manufacturing, 5-Heptenal, 2, 6-dimethyl-: ACTIVE |
Documented applications: Uses: Used as flavoring agent or adjuvant, [FDA], Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Other, Fragrance, Consumer Uses: Fragrance, Other, Household Products: Information on 83 consumer products that contain Dimethyl Heptenal in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Inside the Home, • Personal Care, U.S. Production: 2023: 8, 500, 000 - <10, 000, 000 lb, 2022: 8, 2021: 8, 2020: 8, General Manufacturing Information: Soap, Cleaning Compound, and Toilet Preparation Manufacturing, All Other Chemical Product and Preparation Manufacturing, 5-Heptenal, 2, 6-dimethyl-: ACTIVE.
2,6-Dimethyl-5-heptenal is a chemical compound with CAS registry number 106-72-9 and molecular formula C9H16O (molecular weight 140.12 g/mol).
CAS number: 106-72-9
Its molecular formula C9H16O comprises 9 C, 16 H, 1 O atoms.
Also known as: 2,6-Dimethyl-5-heptenal · 2,6-dimethyl-5-hepten-1-al
The CAS registry number of 2,6-Dimethyl-5-heptenal is 106-72-9.
Molecular formula C9H16O, molecular weight 140.12 g/mol.
It is also registered under: 2,6-Dimethyl-5-heptenal, 2,6-dimethyl-5-hepten-1-al.
Recorded applications: Uses: Used as flavoring agent or adjuvant, [FDA], Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Other, Fragrance, Consumer Uses: Fragrance, Other, Household Products: Information on 83 consumer products that contain Dimethyl Heptenal in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Inside the Home, • Personal Care, U.S. Production: 2023: 8, 500, 000 - <10, 000, 000 lb, 2022: 8, 2021: 8, 2020: 8, General Manufacturing Information: Soap, Cleaning Compound, and Toilet Preparation Manufacturing, All Other Chemical Product and Preparation Manufacturing, 5-Heptenal, 2, 6-dimethyl-: ACTIVE.
Independent reference data for 2,6-Dimethyl-5-heptenal (CAS 106-72-9), compiled from public chemistry databases.
| CAS 号 | 106-72-9 |
|---|---|
| PubChem CID | 61016 |
| 分子式 | C9H16O |
| 分子量 | 140.12 g/mol |
| IUPAC 名称 | 2,6-dimethylhept-5-enal |
| InChIKey | YGFGZTXGYTUXBA-UHFFFAOYSA-N |
| UNII（FDA） | Z331YX9EL9 |
| ChEBI 编号 | CHEBI:229323 |
| FEMA 编号 | 2389 |
| JECFA 编号 | 349 |
| Molecular Weight | 140.22 |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 140.120115130 |
| Monoisotopic Mass | 140.120115130 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 10 |
| Boiling Point | 116-124 °C (100 mm Hg) |
|---|---|
| Density | 0.845-0.854 |
| Vapor Pressure | 0.76 [mmHg] |
| Refractive Index | 1.442-1.448 |
2,6-Dimethyl-5-heptenal; 2,6-Dimethylhept-5-enal; 106-72-9; Melonal; 5-HEPTENAL, 2,6-DIMETHYL-; FEMA No. 2389; 2,6-Dimethylhept-5-en-1-al; DTXSID8044753; dimethyl heptenal; NSC-78450; MELOMOR; Z331YX9EL9; DTXCID6024753; RefChem:445700; 2,6-DMH; (+-)-2,6-dimethyl-5-heptenal
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit, Green, Melon No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS 通报统计 | 0.3% (5 / 1898) |
| GHS 通报统计 | 0.3% (5 / 1898) |
|---|---|
| 已通报的危害声明 | H226 (86.6%), H317 (11.2%) |
甜瓜醛 的 CAS 号为 106-72-9，分子式 C9H16O，分子量 140.12 g/mol。 UNII Z331YX9EL9; ChEBI 229323; InChIKey YGFGZTXGYTUXBA-UHFFFAOYSA-N. Boiling Point: 116-124 °C (100 mm Hg); Density: 0.845-0.854; Vapor Pressure: 0.76 [mmHg].
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2,6-Dimethyl-5-heptenal