Skip Navigation
ChemIDplus Lite•Browse•Advanced

Substance Name: 4-Methylbiphenyl
RN: 644-08-6
UNII: 13J700766D
InChIKey: ZZLCFHIKESPLTH-UHFFFAOYSA-N

Molecular Formula

  • C13-H12

Molecular Weight

  • 168.238
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 4-Methylbiphenyl

Synonyms

  • (4-Methylphenyl)benzene
  • 1,1'-Biphenyl, 4-methyl-
  • 1-Methyl-4-phenylbenzene
  • 4-05-00-01860 (Beilstein Handbook Reference)
  • 4-Methyl-1,1'-biphenyl
  • 4-Methylbiphenyl
  • 4-Methyldiphenyl
  • 4-Phenyltoluene
  • Biphenyl, 4-methyl-
  • BRN 1904468
  • EINECS 211-409-0
  • FEMA 3186
  • FEMA No. 3186
  • Methylphenylbenzene, p-
  • NSC 407669
  • p-Methylbiphenyl
  • p-Methyldiphenyl
  • Phenyltoluene, p-
  • UNII-13J700766D

Systematic Names

  • 1,1'-Biphenyl, 4-methyl-
  • 4-Phenyltoluene
  • Biphenyl, 4-methyl-

Superlist Name

  • 4-Methylbiphenyl

Registry Numbers

CAS Registry Number

  • 644-08-6

FDA UNII

  • 13J700766D

System Generated Number

  • 0000644086

Structure Descriptors

InChI

InChI=1S/C13H12/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h2-10H,1H3

InChIKey

ZZLCFHIKESPLTH-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 2570mg/kg (2570mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 487, 1975.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 49.5 deg C   EXP
Boiling Point 267.5 deg C   EXP
log P (octanol-water) 4.63 (none)   EXP
Water Solubility 4.05 mg/L 25 EXP
Vapor Pressure 6.42E-03 mm Hg 25 EST
Henry's Law Constant 4.55E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.68E-12 cm3/molecule-sec 25 EST

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