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Home Carboxys 2-Aminobenzothiazole-6-carboxylic acid

2-Aminobenzothiazole-6-carboxylic acid

CAS No.:
93-85-6
Catalog Number:
AG006CKC
Molecular Formula:
C8H6N2O2S
Molecular Weight:
194.2104
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$18
- +
5g
98%
In Stock USA
United States
$48
- +
10g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$125
- +
100g
98%
In Stock USA
United States
$357
- +
Product Description
Catalog Number:
AG006CKC
Chemical Name:
2-Aminobenzothiazole-6-carboxylic acid
CAS Number:
93-85-6
Molecular Formula:
C8H6N2O2S
Molecular Weight:
194.2104
MDL Number:
MFCD00054180
IUPAC Name:
2-amino-1,3-benzothiazole-6-carboxylic acid
InChI:
InChI=1S/C8H6N2O2S/c9-8-10-5-2-1-4(7(11)12)3-6(5)13-8/h1-3H,(H2,9,10)(H,11,12)
InChI Key:
ZEAKWWWXCZMODH-UHFFFAOYSA-N
SMILES:
Nc1nc2c(s1)cc(cc2)C(=O)O
EC Number:
202-283-8
NSC Number:
39119
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.208g/mol
Monoisotopic Mass:
194.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
catena-Poly[[(2-amino-1,3-benzothia-zole-6-carboxyl-ato-κ(2)O,O')(2,2'-bipyridyl-κ(2)N,N')cadmium]-μ-2-amino-1,3-benzothia-zole-6-carboxyl-ato-κ(3)N(1):O,O']. Acta crystallographica. Section E, Structure reports online 20120501
catena-Poly[lead(II)-bis-(μ-2-amino-1,3-benzothia-zole-6-carboxyl-ato)]. Acta crystallographica. Section E, Structure reports online 20101201
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Phenylimidazole derivatives as new inhibitors of bacterial enoyl-ACP reductase FabK. Bioorganic & medicinal chemistry letters 20070901
Properties