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3-METHYL-1-PENTANOL

CAS 589-35-5C6H14OMW 102.10 g/mol

3-METHYL-1-PENTANOL (CAS 589-35-5) — formula C6H14O, molecular weight 102.10 g/mol; category organic chemicals.

Product Overview

CAS Number589-35-5
Molecular FormulaC6H14O
Molecular Weight102.10 g/mol
Boiling Point151.00 to 152.00 °C. @ 760.00 mm Hg
LogP1.8
CategoryOrganic Chemicals

Technical Profile

What this product is

3-METHYL-1-PENTANOL is a carbon-based organic compound with CAS registry number 589-35-5 and molecular formula C6H14O (molecular weight 102.10 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 589-35-5

Its molecular formula C6H14O comprises 6 C, 14 H, 1 O atoms.

Also known as: 3-METHYL-1-PENTANOL · 3-甲基-1-戊醇 · 3-methylpentan-1-ol

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3-METHYL-1-PENTANOL?

The CAS registry number of 3-METHYL-1-PENTANOL is 589-35-5.

What is the molecular formula and molecular weight of 3-METHYL-1-PENTANOL?

Molecular formula C6H14O, molecular weight 102.10 g/mol.

What other names is 3-METHYL-1-PENTANOL known by?

It is also registered under: 3-METHYL-1-PENTANOL, 3-甲基-1-戊醇, 3-methylpentan-1-ol.

Which category does 3-METHYL-1-PENTANOL belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3-METHYL-1-PENTANOL (CAS 589-35-5), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number589-35-5
PubChem CID11508
Molecular formulaC6H14O
IUPAC name3-methylpentan-1-ol
UNII (FDA)N8W93SI0FS
FEMA number3762
JECFA number263

Computed descriptors

Molecular Weight102.17
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass102.104465066
Monoisotopic Mass102.104465066
Topological Polar Surface Area20.2
Heavy Atom Count7

Physicochemical values on record

Boiling Point151.00 to 152.00 °C. @ 760.00 mm Hg
Boiling Point151-152 °C
Density0.823
Refractive Index1.418

Documented uses on record

  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index

Synonyms and trade names

3-METHYL-1-PENTANOL; 3-Methylpentan-1-ol; 589-35-5; 3-Methylpentanol; 2-Ethyl-4-butanol; 1-Pentanol, 3-methyl-; 3-Ethyl-1-butanol; FEMA No. 3762; N8W93SI0FS; NSC-9466; CHEBI:87381; DTXSID20862248; RefChem:94705; DTXCID50811042; 209-644-9; MFCD00002937

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
Fruit
No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary9.2% (135 / 1467)

GHS hazard classification

GHS notification summary9.2% (135 / 1467)
Reported hazard statementsH226 (90.8%)

This chemical does not meet GHS hazard criteria for 9.2% (135 of 1467) of reports.

H226 (90.8%): Flammable liquid and vapor [Warning Flammable liquids]

What the public record says

3-methylpentan-1-ol · CAS 589-35-5 · C6H14O. UNII N8W93SI0FS. Boiling Point: 151.00 to 152.00 °C. @ 760.00 mm Hg; Boiling Point: 151-152 °C; Density: 0.823.

Physical description and handling notes

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

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