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Substance Name: Benzene, (1-pentylhexyl)-
RN: 4537-14-8
InChIKey: WCABIRIFXVXGQH-UHFFFAOYSA-N

Molecular Formula

  • C17-H28

Molecular Weight

  • 232.408
 
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Names and Synonyms

Synonym

  • 6-Phenylundecane

Systematic Name

  • Benzene, (1-pentylhexyl)-

Registry Numbers

CAS Registry Number

  • 4537-14-8

System Generated Number

  • 0004537148

Structure Descriptors

InChI

1S/C17H28/c1-3-5-8-12-16(13-9-6-4-2)17-14-10-7-11-15-17/h7,10-11,14-16H,3-6,8-9,12-13H2,1-2H3

InChIKey

WCABIRIFXVXGQH-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(CCCCC)CCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 7.45 (none)   EXP
Water Solubility 0.013 mg/L 25 EST
Vapor Pressure 1.55E-03 mm Hg 25 EST
Henry's Law Constant 0.101 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.87E-11 cm3/molecule-sec 25 EST

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