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Crotonicacidhexenylester

CAS 65405-80-3C10H16O2MW 168.23

Crotonicacidhexenylester (CAS 65405-80-3) — formula C10H16O2, molecular weight 168.23; category organic chemicals.

Product Overview

CAS Number65405-80-3
Molecular FormulaC10H16O2
Molecular Weight168.23
Boiling Point218-219 °C (734 mm Hg)
LogP2.7
CategoryOrganic Chemicals

Technical Profile

What this product is

Crotonicacidhexenylester is a carbon-based organic compound with CAS registry number 65405-80-3 and molecular formula C10H16O2 (molecular weight 168.23), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 65405-80-3

Its molecular formula C10H16O2 comprises 10 C, 16 H, 2 O atoms.

Also known as: Crotonicacidhexenylester · 巴豆酸己烯酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Crotonicacidhexenylester?

The CAS registry number of Crotonicacidhexenylester is 65405-80-3.

What is the molecular formula and molecular weight of Crotonicacidhexenylester?

Molecular formula C10H16O2, molecular weight 168.23.

What other names is Crotonicacidhexenylester known by?

It is also registered under: Crotonicacidhexenylester, 巴豆酸己烯酯.

Which category does Crotonicacidhexenylester belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Crotonicacidhexenylester (CAS 65405-80-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number65405-80-3
PubChem CID16220110
Molecular formulaC10H16O2
IUPAC name[(Z)-hex-3-enyl] (E)-but-2-enoate
UNII (FDA)4SW5S1T63S
FEMA number3982
JECFA number1276

Computed descriptors

Molecular Weight168.23
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass168.115029749
Monoisotopic Mass168.115029749
Topological Polar Surface Area26.3
Heavy Atom Count12

Physicochemical values on record

Boiling Point218-219 °C (734 mm Hg)
Density0.894-0.904
Refractive Index1.427-1.437

Documented uses on record

    Flavoring Agents -> JECFA Flavorings IndexFlavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

    Synonyms and trade names

    65405-80-3; (Z)-3-Hexenyl crotonate; cis-3-Hexenyl trans-2-butenoate; 3-Hexenyl-2-butenoate, (2E,3Z)-; 4SW5S1T63S; 2-Butenoic acid, (3Z)-3-hexenyl ester, (2E)-; 2-Butenoic acid, (3Z)-3-hexen-1-yl ester, (2E)-; (Z)-3-Hexenyl (E)-2-butenoate; EINECS 265-746-3; 2-Butenoic acid, 3-hexenyl ester, (E,Z)-; DTXSID90886759; (Z)-3-HEXENYL (E)-2-BUTENOATE [FHFI]; RefChem:502209; DTXCID601026079; (3Z)-3-Hexen-1-yl (2E)-2-butenoate; 265-746-3

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Green
    3-HEXENYL CROTONATE, CIS-
    GHS notification summary98.9% (90 / 91)

    GHS hazard classification

    GHS notification summary98.9% (90 / 91)

    This chemical does not meet GHS hazard criteria for 98.9% (90 of 91) of all reports.

    Reported as not meeting GHS hazard criteria by 90 of 91 companies (only 1.1% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

    What the public record says

    Crotonicacidhexenylester · CAS 65405-80-3 · C10H16O2. UNII 4SW5S1T63S. Boiling Point: 218-219 °C (734 mm Hg); Density: 0.894-0.904; Refractive Index: 1.427-1.437.

    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.

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