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Substance Name: Cycloheptene
RN: 628-92-2
UNII: KRY3SY05AH
InChIKey: ZXIJMRYMVAMXQP-UHFFFAOYSA-N

Molecular Formula

  • C7-H12

Molecular Weight

  • 96.1718
 
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Names and Synonyms

Name of Substance

  • Cycloheptene

Synonyms

  • EINECS 211-060-4
  • NSC 5162
  • UNII-KRY3SY05AH

Systematic Name

  • Cycloheptene

Superlist Names

  • Cycloheptene [UN2242] [Flammable liquid]
  • UN2242

Registry Numbers

CAS Registry Number

  • 628-92-2

FDA UNII

  • KRY3SY05AH

System Generated Number

  • 0000628922

Structure Descriptors

InChI

1S/C7H12/c1-2-4-6-7-5-3-1/h1-2H,3-7H2

InChIKey

ZXIJMRYMVAMXQP-UHFFFAOYSA-N

Smiles

C1CCC=CCC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -5.60E+01 deg C   EXP
Boiling Point 115 deg C   EXP
log P (octanol-water) 3.450 (none)   EST
Water Solubility 66 mg/L 25 EXP
Vapor Pressure 19.7 mm Hg 25 EST
Henry's Law Constant 0.088 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.40E-11 cm3/molecule-sec 25 EXP

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