2-(phenylmethylene)heptyl acetate (CAS 7493-78-9) — formula C16H22O2, molecular weight 246.34; category organic chemicals.
| CAS Number | 7493-78-9 |
|---|---|
| Molecular Formula | C16H22O2 |
| Molecular Weight | 246.34 |
| Boiling Point | 291 °C |
| LogP | 4.9 |
| Applications | Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 1-Heptanol, 2-(phenylmethylene)-, 1-acetate: INACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 1-Heptanol, 2-(phenylmethylene)-, 1-acetate: INACTIVE.
2-(phenylmethylene)heptyl acetate is a carbon-based organic compound with CAS registry number 7493-78-9 and molecular formula C16H22O2 (molecular weight 246.34), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 7493-78-9
Its molecular formula C16H22O2 comprises 16 C, 22 H, 2 O atoms.
Also known as: 2-(phenylmethylene)heptyl acetate · 2-(苯基亚甲基)乙酸庚酯
Category: organic chemicals
The CAS registry number of 2-(phenylmethylene)heptyl acetate is 7493-78-9.
Molecular formula C16H22O2, molecular weight 246.34.
It is also registered under: 2-(phenylmethylene)heptyl acetate, 2-(苯基亚甲基)乙酸庚酯.
Recorded applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 1-Heptanol, 2-(phenylmethylene)-, 1-acetate: INACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-(phenylmethylene)heptyl acetate (CAS 7493-78-9), compiled from public chemistry databases.
| CAS Registry Number | 7493-78-9 |
|---|---|
| PubChem CID | 582291 |
| Molecular formula | C16H22O2 |
| IUPAC name | 2-benzylideneheptyl acetate |
| UNII (FDA) | VMT186NL85 |
| FEMA number | 2064 |
| JECFA number | 677 |
| Molecular Weight | 246.34 |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 246.161979940 |
| Monoisotopic Mass | 246.161979940 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 18 |
| Boiling Point | 291 °C |
|---|---|
| Density | 0.953-0.961 |
| Refractive Index | 1.487-1.495 |
7493-78-9; 1-Heptanol, 2-(phenylmethylene)-, acetate; alpha-Amylcinnamyl acetate; DTXSID80864081; FEMA No. 2064; 1-Heptanol, 2-(phenylmethylene)-, 1-acetate; 1-Heptanol, 2-benzylidene-, acetate; VMT186NL85; RefChem:1076444; DTXCID70812632; 231-339-4; 2-benzylideneheptyl acetate; 1-Heptanol,2-(phenylmethylene)-, 1-acetate; alpha-amyl cinnamyl acetate; SCHEMBL1171598; CMJSVJIGLBDCME-UHFFFAOYSA-N
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent No safety concern at current levels of intake when used as a flavouring agent TRS 901-JECFA 55/22 |
|---|---|
| GHS notification summary | 100% (234 / 234) |
| GHS notification summary | 100% (234 / 234) |
|---|
This chemical does not meet GHS hazard criteria for 100% (234 of 234) of all reports.
Reported as not meeting GHS hazard criteria by 234 of 234 companies. For more detailed information, please visit ECHA C&L website.
2-(phenylmethylene)heptyl acetate · CAS 7493-78-9 · C16H22O2. UNII VMT186NL85. Boiling Point: 291 °C; Density: 0.953-0.961; Refractive Index: 1.487-1.495.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-(苯基亚甲基)乙酸庚酯