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Allyl cyclohexaneacetate

CAS 4728-82-9C11H18O2MW 182.13 g/mol

Allyl cyclohexaneacetate (CAS 4728-82-9) — formula C11H18O2, molecular weight 182.13 g/mol.

Product Overview

CAS Number4728-82-9
Molecular FormulaC11H18O2
Molecular Weight182.13 g/mol
Boiling Point60.00 to 63.00 °C. @ 1.00 mm Hg
LogP3.4

Technical Profile

What this product is

Allyl cyclohexaneacetate is a chemical compound with CAS registry number 4728-82-9 and molecular formula C11H18O2 (molecular weight 182.13 g/mol).

Identification

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

Frequently Asked Questions

What is the CAS number of Allyl cyclohexaneacetate?

The CAS registry number of Allyl cyclohexaneacetate is 4728-82-9.

What is the molecular formula and molecular weight of Allyl cyclohexaneacetate?

Molecular formula C11H18O2, molecular weight 182.13 g/mol.

What other names is Allyl cyclohexaneacetate known by?

It is also registered under: Allyl cyclohexaneacetate, 环己基乙酸烯丙酯.

PubChem Public Data

Independent reference data for Allyl cyclohexaneacetate (CAS 4728-82-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number4728-82-9
PubChem CID22034852
Molecular formulaC11H18O2
Molecular weight182.13 g/mol
IUPAC nameprop-2-enyl 2-cyclohexylacetate
InChIKeyUECFOOSFSUDPOR-UHFFFAOYSA-N
UNII (FDA)M6J8835739
ChEBI IDCHEBI:195881
FEMA number2023
JECFA number12

Computed descriptors

Molecular Weight182.26
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass182.130679813
Monoisotopic Mass182.130679813
Topological Polar Surface Area26.3
Heavy Atom Count13

Physicochemical values on record

Boiling Point60.00 to 63.00 °C. @ 1.00 mm Hg
Boiling Point60 °C (1 mm Hg)
Density0.945-0.965
Refractive Index1.455-1.499

Documented uses on record

    Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional ClassesFlavoring Agents -> JECFA Flavorings Index

    Synonyms and trade names

    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 listings held on file

    Regulatory & Food ContactEU 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

    GHS hazard classification

    Reported hazard statementsH302 (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]

    What the public record says

    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.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 环己基乙酸烯丙酯

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