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cis-3-hexenyl isobutyrate

CAS 41519-23-7C10H18O2MW 170.25

cis-3-hexenyl isobutyrate (CAS 41519-23-7) — formula C10H18O2, molecular weight 170.25; category organic chemicals.

Product Overview

CAS Number41519-23-7
Molecular FormulaC10H18O2
Molecular Weight170.25
Boiling Point181-182 °C
LogP2.9
CategoryOrganic Chemicals

Technical Profile

What this product is

cis-3-hexenyl isobutyrate is a carbon-based organic compound with CAS registry number 41519-23-7 and molecular formula C10H18O2 (molecular weight 170.25), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 41519-23-7

Its molecular formula C10H18O2 comprises 10 C, 18 H, 2 O atoms.

Also known as: cis-3-hexenyl isobutyrate · 顺-3-己烯基异丁酸酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of cis-3-hexenyl isobutyrate?

The CAS registry number of cis-3-hexenyl isobutyrate is 41519-23-7.

What is the molecular formula and molecular weight of cis-3-hexenyl isobutyrate?

Molecular formula C10H18O2, molecular weight 170.25.

What other names is cis-3-hexenyl isobutyrate known by?

It is also registered under: cis-3-hexenyl isobutyrate, 顺-3-己烯基异丁酸酯.

Which category does cis-3-hexenyl isobutyrate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for cis-3-hexenyl isobutyrate (CAS 41519-23-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number41519-23-7
PubChem CID93832
Molecular formulaC10H18O2
IUPAC namehex-3-enyl 2-methylpropanoate
UNII (FDA)NS00087284
JECFA number1275

Computed descriptors

Molecular Weight170.25
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass170.130679813
Monoisotopic Mass170.130679813
Topological Polar Surface Area26.3
Heavy Atom Count12

Physicochemical values on record

Boiling Point181-182 °C
Density0.882-0.885
Refractive Index1.424-1.432

Documented uses on record

  • Flavoring Agents -> JECFA Flavorings Index

Synonyms and trade names

Hex-3-enyl isobutyrate; (Z)-Hex-3-enyl isobutyrate; RefChem:408696; 260-993-3; Hex-3-en-1-yl 2-methylpropanoate; hex-3-enyl 2-methylpropanoate; 57859-47-9; Cis-3-hexenylester; SCHEMBL112643; (E)-3-hexen-1-yl isobutyrate; DTXSID5047586; OSMAJVWUIUORGC-UHFFFAOYSA-N; AKOS025243527; DB-254911; NS00087284

Regulatory listings held on file

Regulatory & Food ContactFlavoring Agents
GHS notification summary97.4% (1474 / 1514)

GHS hazard classification

GHS notification summary97.4% (1474 / 1514)

This chemical does not meet GHS hazard criteria for 97.4% (1474 of 1514) of all reports.

Reported as not meeting GHS hazard criteria by 1474 of 1514 companies (only 2.6% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

What the public record says

cis-3-hexenyl isobutyrate · CAS 41519-23-7 · C10H18O2. UNII NS00087284. Boiling Point: 181-182 °C; Density: 0.882-0.885; Refractive Index: 1.424-1.432.

Physical description and handling notes

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

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