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2-Mercapto-5-methylbenzimidazole Structure

2-Mercapto-5-methylbenzimidazole

  • Product Name2-Mercapto-5-methylbenzimidazole
  • CAS27231-36-3
  • CBNumberCB6760205
  • MFC8H8N2S
  • MW164.23
  • EINECS248-350-5
  • MDL NumberMFCD00010617
  • MOL File27231-36-3.mol

Chemical Properties

Melting point: 290-293 °C(lit.)
Boiling point: 282.5±33.0 °C(Predicted)
Density  1.1724 (rough estimate)
refractive index  1.5700 (estimate)
storage temp.  Store at room temperature
pka 10.60±0.30(Predicted)
form  powder to crystal
color  White to Light yellow
Water Solubility  Insoluble in water.
BRN  5083
InChI InChI=1S/C8H8N2S/c1-5-2-3-6-7(4-5)10-8(11)9-6/h2-4H,1H3,(H2,9,10,11)
InChIKey CWIYBOJLSWJGKV-UHFFFAOYSA-N
SMILES C1(=S)NC2=CC=C(C)C=C2N1
CAS DataBase Reference 27231-36-3(CAS DataBase Reference)
EPA Substance Registry System 2H-Benzimidazole-2-thione, 1,3-dihydro-5-methyl- (27231-36-3)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36-37/39
WGK Germany  3
Hazard Note  Irritant
TSCA  TSCA listed
HS Code  2933998090
NFPA 704:
1
2 0

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2-Mercapto-5-methylbenzimidazole Chemical Properties,Usage,Production

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2-Mercapto-5-methylbenzimidazole Spectrum