GERANYL ISOVALERATE (CAS 109-20-6) — formula C15H26O2, molecular weight 238.19 g/mol; category organic chemicals.
| CAS Number | 109-20-6 |
|---|---|
| Molecular Formula | C15H26O2 |
| Molecular Weight | 238.19 g/mol |
| Boiling Point | 279 °C |
| LogP | 4.7 |
| Applications | Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Butanoic acid, 3-methyl-, (2E)-3, 7-dimethyl-2, 6-octadien-1-yl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Butanoic acid, 3-methyl-, (2E)-3, 7-dimethyl-2, 6-octadien-1-yl ester: ACTIVE.
GERANYL ISOVALERATE is a carbon-based organic compound with CAS registry number 109-20-6 and molecular formula C15H26O2 (molecular weight 238.19 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 109-20-6
Its molecular formula C15H26O2 comprises 15 C, 26 H, 2 O atoms.
Also known as: GERANYL ISOVALERATE · 异戊酸香叶酯
Category: organic chemicals
The CAS registry number of GERANYL ISOVALERATE is 109-20-6.
Molecular formula C15H26O2, molecular weight 238.19 g/mol.
It is also registered under: GERANYL ISOVALERATE, 异戊酸香叶酯.
Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Butanoic acid, 3-methyl-, (2E)-3, 7-dimethyl-2, 6-octadien-1-yl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for GERANYL ISOVALERATE (CAS 109-20-6), compiled from public chemistry databases.
| CAS 号 | 109-20-6 |
|---|---|
| PubChem CID | 5362830 |
| 分子式 | C15H26O2 |
| 分子量 | 238.19 g/mol |
| IUPAC 名称 | [(2E)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate |
| InChIKey | SOUKTGNMIRUIQN-NTEUORMPSA-N |
| UNII（FDA） | OPO8694RK3 |
| ChEBI 编号 | CHEBI:172479 |
| FEMA 编号 | 2518 |
| JECFA 编号 | 75 |
| Molecular Weight | 238.37 |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 238.193280068 |
| Monoisotopic Mass | 238.193280068 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 17 |
| Boiling Point | 279 °C |
|---|---|
| Density | 0.878-0.899 |
| Refractive Index | 1.454-1.470 |
Geranyl isovalerate; 109-20-6; Geranyl isopentanoate; FEMA No. 2518; Isovaleric acid geranyl ester; Geranyl isovalerate (natural); OPO8694RK3; Butanoic acid, 3-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E)-; [(2E)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate; EINECS 203-655-2; trans-3,7-Dimethyl-2,6-octadienyl isopentanoate; AI3-36015; Isovaleric acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-; GERANYL ISOVALERATE [FCC]; 2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, ISOVALERATE, (E)-; DTXSID10883184
| 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 Apple, Fruit, Rose No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS 通报统计 | 100% (308 / 308) |
| GHS 通报统计 | 100% (308 / 308) |
|---|
异戊酸香叶酯 的 CAS 号为 109-20-6，分子式 C15H26O2，分子量 238.19 g/mol。 UNII OPO8694RK3; ChEBI 172479; InChIKey SOUKTGNMIRUIQN-NTEUORMPSA-N. Boiling Point: 279 °C; Density: 0.878-0.899; Refractive Index: 1.454-1.470.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 异戊酸香叶酯