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Substance Name: 3-Heptene, (3E)-
RN: 14686-14-7
UNII: O4BR0A824I
InChIKey: WZHKDGJSXCTSCK-FNORWQNLSA-N

Molecular Formula

  • C7-H14

Molecular Weight

  • 98.1876
 
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Names and Synonyms

Name of Substance

  • 3-Heptene, (3E)-

Synonyms

  • (E)-3-Heptene
  • EINECS 238-728-8
  • NSC 74133
  • trans-3-Heptene
  • UNII-O4BR0A824I

Systematic Names

  • (E)-Hept-3-ene
  • 3-Heptene, (E)-
  • 3-Heptene, (E)- (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 14686-14-7

FDA UNII

  • O4BR0A824I

System Generated Number

  • 0014686147

Structure Descriptors

InChI

1S/C7H14/c1-3-5-7-6-4-2/h5,7H,3-4,6H2,1-2H3/b7-5+

InChIKey

WZHKDGJSXCTSCK-FNORWQNLSA-N

Smiles

C(\CCC)=C\CC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.37E+02 deg C   EXP
Boiling Point 95.7 deg C   EXP
log P (octanol-water) 3.560 (none)   EST
Water Solubility 31.1 mg/L 25 EST
Vapor Pressure 52.4 mm Hg 25 EXP
Henry's Law Constant 0.562 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.00E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.