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Substance Name: 1,3-Cyclohexadiene
RN: 592-57-4
UNII: JV5W0EG5BP
InChIKey: MGNZXYYWBUKAII-UHFFFAOYSA-N

Molecular Formula

  • C6-H8

Molecular Weight

  • 80.1292
 
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Names and Synonyms

Name of Substance

  • 1,3-Cyclohexadiene

Synonyms

  • 1,3-Cyclohexadiene
  • EINECS 209-764-1
  • UNII-JV5W0EG5BP

Systematic Name

  • 1,3-Cyclohexadiene

Registry Numbers

CAS Registry Number

  • 592-57-4

FDA UNII

  • JV5W0EG5BP

Other Registry Number

  • 33004-09-0

System Generated Number

  • 0000592574

Structure Descriptors

InChI

1S/C6H8/c1-2-4-6-5-3-1/h1-4H,5-6H2

InChIKey

MGNZXYYWBUKAII-UHFFFAOYSA-N

Smiles

C1CC=CC=C1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -8.90E+01 deg C   EXP
Boiling Point 80.5 deg C   EXP
log P (octanol-water) 2.47 (none)   EXP
Water Solubility 295 mg/L 25 EST
Vapor Pressure 97.3 mm Hg 25 EXP
Henry's Law Constant 0.084 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.64E-10 cm3/molecule-sec 25 EXP

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