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pentyl isovalerate

CAS 25415-62-7C10H20O2MW 172.26

pentyl isovalerate (CAS 25415-62-7) — formula C10H20O2, molecular weight 172.26; category organic chemicals.

Product Overview

CAS Number25415-62-7
Molecular FormulaC10H20O2
Molecular Weight172.26
Boiling Point169.00 to 170.00 °C. @ 760.00 mm Hg
LogP3.2
CategoryOrganic Chemicals

Technical Profile

What this product is

pentyl isovalerate is a carbon-based organic compound with CAS registry number 25415-62-7 and molecular formula C10H20O2 (molecular weight 172.26), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 25415-62-7

Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms.

Also known as: pentyl isovalerate · 异戊酸戊酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of pentyl isovalerate?

The CAS registry number of pentyl isovalerate is 25415-62-7.

What is the molecular formula and molecular weight of pentyl isovalerate?

Molecular formula C10H20O2, molecular weight 172.26.

What other names is pentyl isovalerate known by?

It is also registered under: pentyl isovalerate, 异戊酸戊酯.

Which category does pentyl isovalerate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for pentyl isovalerate (CAS 25415-62-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number25415-62-7
PubChem CID95978
Molecular formulaC10H20O2
IUPAC namepentyl 3-methylbutanoate
UNII (FDA)E28KFH7P99

Computed descriptors

Molecular Weight172.26
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass172.146329876
Monoisotopic Mass172.146329876
Topological Polar Surface Area26.3
Heavy Atom Count12

Physicochemical values on record

Boiling Point169.00 to 170.00 °C. @ 760.00 mm Hg

Documented uses on record

  • Butanoic acid, 3-methyl-, pentyl ester: ACTIVE

Synonyms and trade names

25415-62-7; Amyl isovalerate; Pentyl isovalerate; Butanoic acid, 3-methyl-, pentyl ester; Pentyl 3-methylbutyrate; 1-Pentyl isovalerate; Isovaleric acid, pentyl ester; AI3-33587; EINECS 246-954-3; NSC 46107; DTXSID1067093; Isovaleric acid, pentyl ester (8CI); RefChem:571439; DTXCID9037298; 246-954-3; Pentyl 3-methylbutanoate

Regulatory listings held on file

Regulatory & Food ContactEU Flavoring substances
Flavoring Agents
GHS notification summary99.3% (138 / 139)

GHS hazard classification

GHS notification summary99.3% (138 / 139)

This chemical does not meet GHS hazard criteria for 99.3% (138 of 139) of all reports.

Reported as not meeting GHS hazard criteria by 138 of 139 companies (only 0.7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

What the public record says

pentyl isovalerate · CAS 25415-62-7 · C10H20O2. UNII E28KFH7P99. Boiling Point: 169.00 to 170.00 °C. @ 760.00 mm Hg.

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

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