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Substance Name: Thiochrome
RN: 92-35-3
UNII: 65UT4V5Z34
InChIKey: GTQXMAIXVFLYKF-UHFFFAOYSA-N

Molecular Formula

  • C12-H14-N4-O-S

Molecular Weight

  • 262.336
 
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Names and Synonyms

Name of Substance

  • Thiochrome

Synonyms

  • EINECS 202-149-9
  • NSC 56339
  • Thiachrome
  • Thiochrome
  • UNII-65UT4V5Z34

Systematic Names

  • 2-(2,7-Dimethyl-5H-thiazolo(3',2':1,2)pyrimido(4,5-d)pyrimidin-8-yl)ethanol
  • 5H-Pyrimido(4,5-d)thiazolo(3,2-a)pyrimidine-8-ethanol, 2,7-dimethyl-
  • 5H-Thiachromine-8-ethanol, 2,7-dimethyl- (9CI)
  • Thiachromine-8-ethanol, 2,7-dimethyl- (8CI)

Registry Numbers

CAS Registry Number

  • 92-35-3

FDA UNII

  • 65UT4V5Z34

Other Registry Number

  • 51810-67-4

System Generated Number

  • 0000092353

Structure Descriptors

InChI

1S/C12H14N4OS/c1-7-10(3-4-17)18-12-15-11-9(6-16(7)12)5-13-8(2)14-11/h5,17H,3-4,6H2,1-2H3

InChIKey

GTQXMAIXVFLYKF-UHFFFAOYSA-N

Smiles

n1cc2c(nc1C)N=C1N(C(=C(CCO)S1)C)C2

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 228.8 deg C   EXP
log P (octanol-water) -0.010 (none)   EST
Atmospheric OH Rate Constant 8.87E-11 cm3/molecule-sec 25 EST

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