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Substance Name: Benzenethiol, p-(dimethylamino)-
RN: 4946-22-9
InChIKey: PQSBRHXGVPVYFJ-UHFFFAOYSA-N

Molecular Formula

  • C8-H11-N-S

Molecular Weight

  • 153.248
 
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Names and Synonyms

Synonyms

  • 4-(Dimethylamino)thiophenol
  • 4-13-00-01308 (Beilstein Handbook Reference)
  • 4-Dimethylaminobenzenethiol
  • BRN 1635423
  • p-Dimethylaminobenzenethiol
  • USAF PD-101

Systematic Name

  • Benzenethiol, p-(dimethylamino)-

Registry Numbers

CAS Registry Number

  • 4946-22-9

System Generated Number

  • 0004946229

Structure Descriptors

InChI

1S/C8H11NS/c1-9(2)7-3-5-8(10)6-4-7/h3-6,10H,1-2H3

InChIKey

PQSBRHXGVPVYFJ-UHFFFAOYSA-N

Smiles

c1(N(C)C)ccc(S)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   National Technical Information Service. Vol. AD603-561,

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.860 (none)   EST
Water Solubility 263 mg/L 25 EST
Vapor Pressure 0.062 mm Hg 25 EST
Henry's Law Constant 8.30E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.02E-10 cm3/molecule-sec 25 EST

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