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Substance Name: 4-Isopropylbiphenyl
RN: 7116-95-2
UNII: 4KBV29724I
InChIKey: KWSHGRJUSUJPQD-UHFFFAOYSA-N

Molecular Formula

  • C15-H16

Molecular Weight

  • 196.291
 
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Names and Synonyms

Name of Substance

  • 4-Isopropylbiphenyl

Synonyms

  • 1,1'-Biphenyl, 4-(1-methylethyl)-
  • 4-07-00-01638 (Beilstein Handbook Reference)
  • 4-Isopropylbiphenyl
  • BRN 1858288
  • EINECS 230-420-1
  • p-Isopropyldiphenyl
  • UNII-4KBV29724I

Systematic Names

  • 1,1'-Biphenyl, 4-(1-methylethyl)-
  • 4-Isopropylbiphenyl
  • Biphenyl, 4-isopropyl-

Registry Numbers

CAS Registry Number

  • 7116-95-2

FDA UNII

  • 4KBV29724I

System Generated Number

  • 0007116952

Structure Descriptors

InChI

1S/C15H16/c1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-12H,1-2H3

InChIKey

KWSHGRJUSUJPQD-UHFFFAOYSA-N

Smiles

c1(c2ccccc2)ccc(C(C)C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 8500mg/kg (8500mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 49(4), Pg. 90, 1984.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 5.51 (none)   EXP
Water Solubility 0.900 mg/L 25 EST
Vapor Pressure 8.18E-04 mm Hg 25 EST
Henry's Law Constant 8.05E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.74E-12 cm3/molecule-sec 25 EST

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