2-Octanone - CAS 111-13-7

Catalog: BB002718
Product Name: 2-Octanone
CAS: 111-13-7
Synonyms: octan-2-one
2-Octanone
IUPAC Name:octan-2-one
Description:2-Octanone (CAS# 111-13-7) is a reagent used as a fragrance and flavoring ingredient.
Molecular Weight:128.21
Molecular Formula:C8H16O
Canonical SMILES:CCCCCCC(=O)C
InChI:InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3
InChI Key:ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
Boiling Point:172.50 ℃ (EPI 4.0)
Melting Point:-16°C
Flash Point:55°C
Purity:97.5 %
Density:0.819 g/cm3
Solubility:H2O=884.2mg/L @ 25 ℃; soluble in alcohol.
Appearance:Colorless to pale yellow liquid
Storage:Store tightly sealed under inert gas in a cool, well-ventilated area.
Decomposition:When heated to decomposition it emits acrid smoke and irritating fumes
MDL:MFCD00009540
LogP:2.54580
Refractive Index:1.414 : 1.418 at 20 deg C
Stability:Stable. Incompatible with strong oxidizing agents. Flammable.
Vapor Pressure:1.35 [mmHg]

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