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Substance Name: Benzenamine, 4-butyl-
RN: 104-13-2
InChIKey: OGIQUQKNJJTLSZ-UHFFFAOYSA-N

Molecular Formula

  • C10-H15-N

Molecular Weight

  • 149.236
 
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Names and Synonyms

Synonyms

  • 1-Amino-4-butylbenzene
  • 4-12-00-02807 (Beilstein Handbook Reference)
  • 4-Butylbenzenamine
  • BRN 1447268
  • EINECS 203-177-4
  • p-Aminobutylbenzene
  • p-Butylaminobenzene
  • p-Butylaniline
  • p-n-Butylaniline

Systematic Names

  • 4-Butylaniline
  • Aniline, 4-butyl-
  • Benzenamine, 4-butyl-

Registry Numbers

CAS Registry Number

  • 104-13-2

System Generated Number

  • 0000104132

Structure Descriptors

InChI

1S/C10H15N/c1-2-3-4-9-5-7-10(11)8-6-9/h5-8H,2-4,11H2,1H3

InChIKey

OGIQUQKNJJTLSZ-UHFFFAOYSA-N

Smiles

c1(ccc(N)cc1)CCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 81mg/kg (81mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 900, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 261 deg C   EXP
log P (octanol-water) 3.05 (none)   EXP
Water Solubility 190 mg/L 25 EST
Vapor Pressure 0.011 mm Hg 25 EST
Henry's Law Constant 4.92E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.35E-10 cm3/molecule-sec 25 EST

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