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2-Mercapto-5-nitrobenzimidazole Structure

2-Mercapto-5-nitrobenzimidazole

  • Product Name2-Mercapto-5-nitrobenzimidazole
  • CAS6325-91-3
  • CBNumberCB8356459
  • MFC7H5N3O2S
  • MW195.2
  • MDL NumberMFCD00804727
  • MOL File6325-91-3.mol

Chemical Properties

Melting point: 274 °C (dec.) (lit.)
Boiling point: 348.4±44.0 °C(Predicted)
Density  1.4666 (rough estimate)
refractive index  1.6740 (estimate)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  1 M NaOH: soluble50mg/mL, opaque, dark red
pka 9.22±0.30(Predicted)
form  Solid
color  Light Yellow to Light Orange
BRN  172127
InChI InChI=1S/C7H5N3O2S/c11-10(12)4-1-2-5-6(3-4)9-7(13)8-5/h1-3H,(H2,8,9,13)
InChIKey YPXQSGWOGQPLQO-UHFFFAOYSA-N
SMILES C1(=S)NC2=CC=C([N+]([O-])=O)C=C2N1
CAS DataBase Reference 6325-91-3(CAS DataBase Reference)
EPA Substance Registry System 2H-Benzimidazole-2-thione, 1,3-dihydro-5-nitro- (6325-91-3)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs Respiratory system
PPE dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
TSCA  TSCA listed
HS Code  2933990099
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
1
2 0

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

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