3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE (CAS 139-70-8) — formula C18H26O2, molecular weight 274.4; category organic chemicals.
| CAS Number | 139-70-8 |
|---|---|
| Molecular Formula | C18H26O2 |
| Molecular Weight | 274.4 |
| Boiling Point | 342.00 °C. @ 760.00 mm Hg |
| LogP | 5.4 |
| Applications | Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Benzeneacetic acid, 3, 7-dimethyl-6-octen-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: Benzeneacetic acid, 3, 7-dimethyl-6-octen-1-yl ester: ACTIVE.
3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE is a carbon-based organic compound with CAS registry number 139-70-8 and molecular formula C18H26O2 (molecular weight 274.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 139-70-8
Its molecular formula C18H26O2 comprises 18 C, 26 H, 2 O atoms.
Also known as: 3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE · citronellyl phenylacetate
Category: organic chemicals
The CAS registry number of 3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE is 139-70-8.
Molecular formula C18H26O2, molecular weight 274.4.
It is also registered under: 3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE, citronellyl phenylacetate.
Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Benzeneacetic acid, 3, 7-dimethyl-6-octen-1-yl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for 3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE (CAS 139-70-8), compiled from public chemistry databases.
| CAS Registry Number | 139-70-8 |
|---|---|
| PubChem CID | 8767 |
| Molecular formula | C18H26O2 |
| IUPAC name | 3,7-dimethyloct-6-enyl 2-phenylacetate |
| UNII (FDA) | HH43UJ4D76 |
| FEMA number | 2315 |
| JECFA number | 1021 |
| Molecular Weight | 274.4 |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 9 |
| Exact Mass | 274.193280068 |
| Monoisotopic Mass | 274.193280068 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 20 |
| Boiling Point | 342.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 342 °C |
| Density | 0.958-0.960 |
| Refractive Index | 1.492-1.510 |
Citronellyl phenylacetate; 139-70-8; Citronellyl alpha-toluate; FEMA No. 2315; Benzeneacetic acid, 3,7-dimethyl-6-octenyl ester; 3,7-Dimethyl-6-octen-1-yl phenylacetate; 3,7-DIMETHYLOCT-6-EN-1-YL 2-PHENYLACETATE; 3,7-Dimethyl-6-octenyl benzeneacetate; Benzeneacetic acid, 3,7-dimethyl-6-octen-1-yl ester; EINECS 205-373-5; UNII-HH43UJ4D76; ACETIC ACID, PHENYL-, 3,7-DIMETHYL-6-OCTENYL ESTER; HH43UJ4D76; PHENYLACETIC ACID, 3,7-DIMETHYL-6-OCTENYL ESTER; DTXSID90861804; CITRONELLYL .ALPHA.-TOLUATE
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (91 / 91) |
| GHS notification summary | 100% (91 / 91) |
|---|
This chemical does not meet GHS hazard criteria for 100% (91 of 91) of all reports.
Reported as not meeting GHS hazard criteria by 91 of 91 companies. For more detailed information, please visit ECHA C&L website.
3,7-DIMETHYL-6-OCTEN-1-YL PHENYLACETATE · CAS 139-70-8 · C18H26O2. UNII HH43UJ4D76. Boiling Point: 342.00 °C. @ 760.00 mm Hg; Boiling Point: 342 °C; Density: 0.958-0.960.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.