Home Carboxys Benzodiazole-5-carboxylic acid HCl

Benzodiazole-5-carboxylic acid HCl

CAS No.:
1158444-99-5
Catalog Number:
AG00948S
Molecular Formula:
C8H7ClN2O2
Molecular Weight:
198.6064
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
96%
In Stock USA
United States
$25
- +
25g
96%
In Stock USA
United States
$75
- +
100g
96%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG00948S
Chemical Name:
Benzodiazole-5-carboxylic acid HCl
CAS Number:
1158444-99-5
Molecular Formula:
C8H7ClN2O2
Molecular Weight:
198.6064
MDL Number:
MFCD02856476
IUPAC Name:
3H-benzimidazole-5-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H6N2O2.ClH/c11-8(12)5-1-2-6-7(3-5)10-4-9-6;/h1-4H,(H,9,10)(H,11,12);1H
InChI Key:
DDMPIPCSFLSDEX-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)nc[nH]2.Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
198.606g/mol
Monoisotopic Mass:
198.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties