Home Other Building Blocks 6-Nitro-1H-benzoimidazole-2-thiol

6-Nitro-1H-benzoimidazole-2-thiol

CAS No.:
6325-91-3
Catalog Number:
AG003HI4
Molecular Formula:
C7H5N3O2S
Molecular Weight:
195.1985
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(HPLC)
1 week
United States
$231
- +
25g
>98.0%(HPLC)
1 week
United States
$784
- +
Product Description
Catalog Number:
AG003HI4
Chemical Name:
6-Nitro-1H-benzoimidazole-2-thiol
CAS Number:
6325-91-3
Molecular Formula:
C7H5N3O2S
Molecular Weight:
195.1985
MDL Number:
MFCD00804727
IUPAC Name:
5-nitro-1,3-dihydrobenzimidazole-2-thione
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)
InChI Key:
YPXQSGWOGQPLQO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)nc([nH]2)S
NSC Number:
31137
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.01g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.196g/mol
Monoisotopic Mass:
195.01g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties