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Substance Name: 3-Hexenyl formate, (3Z)-
RN: 33467-73-1
UNII: E34OB83TYM
InChIKey: XJHQVZQZUGLZLS-ARJAWSKDSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C7-H12-O2

Molecular Weight

  • 128.17
 
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Names and Synonyms

Name of Substance

  • 3-Hexenyl formate, (3Z)-

Synonyms

  • 3-Hexen-1-ol, formate, (Z)-
  • 3-Hexenyl methanoate, cis-
  • AI3-35961
  • beta,gamma-Hexenyl methanoate
  • cis-3-Hexen-1-ol formate
  • cis-3-Hexenyl formate
  • cis-beta-Hexenyl formate
  • EINECS 251-532-7
  • FEMA No. 3353
  • UNII-E34OB83TYM

Systematic Names

  • (Z)-Hex-3-enyl formate
  • 3-Hexen-1-ol, 1-formate, (3Z)-
  • 3-Hexen-1-ol, formate, (3Z)-
  • 3-Hexen-1-ol, formate, (Z)-

Superlist Name

  • 3-Hexenyl formate, cis-

Registry Numbers

CAS Registry Number

  • 33467-73-1

FDA UNII

  • E34OB83TYM

System Generated Number

  • 0033467731

Structure Descriptors

InChI

1S/C7H12O2/c1-2-3-4-5-6-9-7-8/h3-4,7H,2,5-6H2,1H3/b4-3-

InChIKey

XJHQVZQZUGLZLS-ARJAWSKDSA-N

Smiles

C(\C=C/CC)COC=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 797, 1979.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 797, 1979.