Identification

Namehexane nitrile
CAS Number628-73-9
EINECS211-052-0
FDA UNIIS1XKP5498P
Molecular FormulaC6 H11 N
Molecular Weight97.16067000
MDL NumberMFCD00001979
Nikkaji NumberJ6.881K
Beilstein1633601
XlogP31.70 (est)

Regulatory

Physical Properties

Assay 98.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.80600 to 0.81000 @ 20.00 °C.
Pounds per Gallon - (est). 6.715 to 6.748
Refractive Index 1.40500 to 1.40900 @ 20.00 °C.
Melting Point 163.00 to 164.00 °C. @ 760.00 mm Hg
Boiling Point 163.60 °C. @ 760.00 mm Hg
Vapor Pressure 1.961000 mmHg @ 25.00 °C. (est)
Flash Point 110.00 °F. TCC ( 43.00 °C. )
logP (o/w) 1.660
Soluble in alcohol

No sensory data available

Safety Information

Preferred SDSView
European informationMost important hazard(s):
Oral/Parenteral Toxicityoral-mouse LD50 463 mg/kg
Dermal Toxicitysubcutaneous-guinea pig LDLo 310 mg/kg
Inhalation ToxicityNot determined

GHS Classification

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

Safety in Use

Categoryfragrance agents
RIFM Fragrance Material Safety AssessmentSearch
Recommendation for hexane nitrile usage levels up to0.0100 % in the fragrance concentrate.
Recommendation for hexane nitrile flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

egg cooked egg PMC kohlrabi stem

Synonyms

capronitrile N- capronitrile 1- cyanopentane hexanenitrile hexanonitrile pentyl cyanide tricapronile Try the PubMed Search.