Identification

Namevaleronitrile
IUPACpentanenitrile
CAS Number110-59-8
EINECS203-781-8
FDA UNIIX44H3R47D4
Molecular FormulaC5 H9 N
Molecular Weight83.13373000
MDL NumberMFCD00001974
Nikkaji NumberJ5.095D
Beilstein1736706
XlogP31.10 (est)

Regulatory

Physical Properties

Appearance colorless to pale yellow clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.79900 to 0.80100 @ 20.00 °C.
Pounds per Gallon - (est). 6.656 to 6.673
Refractive Index 1.39600 to 1.39800 @ 20.00 °C.
Boiling Point 141.00 to 142.00 °C. @ 760.00 mm Hg
Vapor Pressure 5.794000 mmHg @ 25.00 °C. (est)
Flash Point 105.00 °F. TCC ( 40.56 °C. )
logP (o/w) 1.120
Soluble in alcohol
Insoluble in water

No sensory data available

Safety Information

Preferred SDSView
Oral/Parenteral Toxicityoral-mouse LD50 191 mg/kg
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categorynatural substances and extractives
Recommendation for valeronitrile usage levels up tonot for fragrance use.
Recommendation for valeronitrile flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

egg cooked egg PMC

Synonyms

1,4- butanedinitrile 1- butyl cyanide N- butyl cyanide N- butyronitrile 1- cyanobutane pentane nitrile pentanenitrile succinic acid nitrile succinic dinitrile succinodinitrile N- valeronitrile Try the PubMed Search.