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Substance Name: 1,2,3,6,7,8-Hexahydropyrene
RN: 1732-13-4
UNII: X8B2RZG0YM
InChIKey: MBAIEZXRGAOPKH-UHFFFAOYSA-N

Molecular Formula

  • C16-H16

Molecular Weight

  • 208.302
 
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Names and Synonyms

Name of Substance

  • 1,2,3,6,7,8-Hexahydropyrene

Synonyms

  • 1,2,3,6,7,8-Hexahydropyrene
  • EINECS 217-061-6
  • NSC 60599
  • UNII-X8B2RZG0YM

Systematic Names

  • 1,2,3,6,7,8-Hexahydropyrene
  • Pyrene, 1,2,3,6,7,8-hexahydro- (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 1732-13-4

FDA UNII

  • X8B2RZG0YM

System Generated Number

  • 0001732134

Structure Descriptors

InChI

1S/C16H16/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h7-10H,1-6H2

InChIKey

MBAIEZXRGAOPKH-UHFFFAOYSA-N

Smiles

c1c2CCCc3c2c2c(cc3)CCCc2c1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 133 deg C   EXP
log P (octanol-water) 6.120 (none)   EST
Water Solubility 0.229 mg/L 45 EXP
Atmospheric OH Rate Constant 2.05E-10 cm3/molecule-sec 25 EST

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