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Substance Name: 2-Hexenyl acetate, (2E)-
RN: 2497-18-9
UNII: XDV436N45E
InChIKey: HRHOWZHRCRZVCU-AATRIKPKSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C8-H14-O2

Molecular Weight

  • 142.1966
 
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Names and Synonyms

Name of Substance

  • 2-Hexenyl acetate, (2E)-

Synonyms

  • (E)-2-Hexenyl acetate
  • 2-Hexen-1-ol, acetate, (E)-
  • 2-Hexen-1-yl acetate, trans-
  • 2-Hexen-1-yl-acetate
  • 4-02-00-00187 (Beilstein Handbook Reference)
  • AI3-34393
  • BRN 1721851
  • EINECS 219-680-7
  • FEMA No. 2564
  • trans-2-Hexenyl acetate
  • UNII-XDV436N45E

Systematic Names

  • 2-Hexen-1-ol, 1-acetate, (2E)-
  • 2-Hexen-1-ol, acetate, (2E)-
  • 2-Hexen-1-ol, acetate, (E)-
  • trans-Hex-2-enyl acetate

Superlist Name

  • 2-Hexenyl acetate, trans-

Registry Numbers

CAS Registry Number

  • 2497-18-9

FDA UNII

  • XDV436N45E

System Generated Number

  • 0002497189

Structure Descriptors

InChI

1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h5-6H,3-4,7H2,1-2H3/b6-5+

InChIKey

HRHOWZHRCRZVCU-AATRIKPKSA-N

Smiles

CCC\C=C\COC(=O)C

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. 793, 1979.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 793, 1979.