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Home Nitros 2-Amino-5-nitrobenzenethiol

2-Amino-5-nitrobenzenethiol

CAS No.:
23451-98-1
Catalog Number:
AG00BH2D
Molecular Formula:
C6H6N2O2S
Molecular Weight:
170.1890
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$225
- +
1g
95%
In Stock USA
United States
$563
- +
5g
95%
In Stock USA
United States
$1604
- +
Product Description
Catalog Number:
AG00BH2D
Chemical Name:
2-Amino-5-nitrobenzenethiol
CAS Number:
23451-98-1
Molecular Formula:
C6H6N2O2S
Molecular Weight:
170.1890
MDL Number:
MFCD17014610
IUPAC Name:
2-amino-5-nitrobenzenethiol
InChI:
InChI=1S/C6H6N2O2S/c7-5-2-1-4(8(9)10)3-6(5)11/h1-3,11H,7H2
InChI Key:
UJDSRXSZJCJVCS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)S)N
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.186g/mol
Monoisotopic Mass:
170.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Synthesis and antitumor evaluation of novel derivatives of 6-amino-2-phenylbenzothiazoles. Molecules (Basel, Switzerland) 20060509
Antitumor efficiency of novel fluoro-substituted 6-amino-2-phenylbenzothiazole hydrochloride salts in vitro and in vivo. Methods and findings in experimental and clinical pharmacology 20060101
Properties