Allyl cyclohexaneacetate (CAS 4728-82-9) — formula C11H18O2, molecular weight 182.13 g/mol.
| CAS Number | 4728-82-9 |
|---|---|
| Molecular Formula | C11H18O2 |
| Molecular Weight | 182.13 g/mol |
| Boiling Point | 60.00 to 63.00 °C. @ 1.00 mm Hg |
| LogP | 3.4 |
Allyl cyclohexaneacetate is a chemical compound with CAS registry number 4728-82-9 and molecular formula C11H18O2 (molecular weight 182.13 g/mol).
CAS number: 4728-82-9
Its molecular formula C11H18O2 comprises 11 C, 18 H, 2 O atoms.
Also known as: Allyl cyclohexaneacetate · 环己基乙酸烯丙酯
The CAS registry number of Allyl cyclohexaneacetate is 4728-82-9.
Molecular formula C11H18O2, molecular weight 182.13 g/mol.
It is also registered under: Allyl cyclohexaneacetate, 环己基乙酸烯丙酯.
Independent reference data for Allyl cyclohexaneacetate (CAS 4728-82-9), compiled from public chemistry databases.
| CAS Registry Number | 4728-82-9 |
|---|---|
| PubChem CID | 22034852 |
| Molecular formula | C11H18O2 |
| Molecular weight | 182.13 g/mol |
| IUPAC name | prop-2-enyl 2-cyclohexylacetate |
| InChIKey | UECFOOSFSUDPOR-UHFFFAOYSA-N |
| UNII (FDA) | M6J8835739 |
| ChEBI ID | CHEBI:195881 |
| FEMA number | 2023 |
| JECFA number | 12 |
| Molecular Weight | 182.26 |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 182.130679813 |
| Monoisotopic Mass | 182.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 13 |
| Boiling Point | 60.00 to 63.00 °C. @ 1.00 mm Hg |
|---|---|
| Boiling Point | 60 °C (1 mm Hg) |
| Density | 0.945-0.965 |
| Refractive Index | 1.455-1.499 |
Allyl cyclohexylacetate; Allyl cyclohexaneacetate; 4728-82-9; Cyclohexylacetic acid allyl ester; 2-Propenyl cyclohexaneacetate; Cyclohexaneacetic acid, 2-propenyl ester; FEMA No. 2023; Allyl hexahydrophenylacetate; Cyclohexaneacetic acid, allyl ester; Acetic acid, cyclohexyl-, allyl ester; 2-Propen-1-yl cyclohexaneacetate; EINECS 225-230-0; prop-2-en-1-yl 2-cyclohexylacetate; BRN 2575626; Cyclohexaneacetic acid, 2-propen-1-yl ester; UNII-M6J8835739
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Apricot, Fruit, Peach, Pineapple No safety concern at current levels of intake when used as a flavouring agent |
|---|
| Reported hazard statements | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H301, H311 |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
Allyl cyclohexaneacetate is identified by CAS 4728-82-9, molecular formula C11H18O2 and molecular weight 182.13 g/mol. UNII M6J8835739; ChEBI 195881; InChIKey UECFOOSFSUDPOR-UHFFFAOYSA-N. Boiling Point: 60.00 to 63.00 °C. @ 1.00 mm Hg; Boiling Point: 60 °C (1 mm Hg); Density: 0.945-0.965.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 环己基乙酸烯丙酯