5-Amino-2-benzimidazolethiol Structure

5-Amino-2-benzimidazolethiol

Chemical Properties

Melting point 240-244 °C (lit.)
Boiling point 356.8±44.0 °C(Predicted)
Density  1.2404 (rough estimate)
refractive index  1.5605 (estimate)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  DMSO (Slightly), Methanol (Slightly, Heated)
form  powder to crystal
pka 10.44±0.30(Predicted)
color  Light yellow to Amber to Dark green
Stability Stable under recommended storage conditions., Stable Under Recommended Storage C
InChI InChI=1S/C7H7N3S/c8-4-1-2-5-6(3-4)10-7(11)9-5/h1-3H,8H2,(H2,9,10,11)
InChIKey BXDMTLVCACMNJO-UHFFFAOYSA-N
SMILES C1(=S)NC2=CC=C(N)C=C2N1
CAS DataBase Reference 2818-66-8(CAS DataBase Reference)
FDA UNII 98S1PF37NB
EPA Substance Registry System 2H-Benzimidazole-2-thione, 5-amino-1,3-dihydro- (2818-66-8)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
TSCA  TSCA listed
HS Code  2933998090
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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