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Substance Name: 1,1-Dimethyl-2-thiourea
RN: 6972-05-0
UNII: E9F6NSU1N5
InChIKey: ZQGWBPQBZHMUFG-UHFFFAOYSA-N

Molecular Formula

  • C3-H8-N2-S

Molecular Weight

  • 104.176
 
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Names and Synonyms

Name of Substance

  • 1,1-Dimethyl-2-thiourea

Synonyms

  • 1,1-Dimethylthiourea
  • AI3-17358
  • EINECS 230-204-7
  • N,N-Dimethylthiourea
  • NSC 67246
  • UNII-E9F6NSU1N5

Systematic Names

  • 1,1-Dimethyl-2-thiourea
  • Thiourea, N,N-dimethyl- (9CI)
  • Urea, 1,1-dimethyl-2-thio- (8CI)

Registry Numbers

CAS Registry Number

  • 6972-05-0

FDA UNII

  • E9F6NSU1N5

System Generated Number

  • 0006972050

Structure Descriptors

InChI

1S/C3H8N2S/c1-5(2)3(4)6/h1-2H3,(H2,4,6)

InChIKey

ZQGWBPQBZHMUFG-UHFFFAOYSA-N

Smiles

NC(=S)N(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.43 (none)   EXP
Water Solubility 1.32E+05 mg/L 25 EST
Vapor Pressure 2.000 mm Hg 25 EST
Henry's Law Constant 7.61E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.95E-11 cm3/molecule-sec 25 EST

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