Home Carboxys 2-Oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylic acid

2-Oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylic acid

CAS No.:
23814-14-4
Catalog Number:
AG006UHP
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$312
- +
10g
98%
In Stock USA
United States
$524
- +
Product Description
Catalog Number:
AG006UHP
Chemical Name:
2-Oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylic acid
CAS Number:
23814-14-4
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
MDL Number:
MFCD01233165
IUPAC Name:
2-oxo-1,3-dihydrobenzimidazole-5-carboxylic acid
InChI:
InChI=1S/C8H6N2O3/c11-7(12)4-1-2-5-6(3-4)10-8(13)9-5/h1-3H,(H,11,12)(H2,9,10,13)
InChI Key:
YIGYJEWJHOCKSR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)[nH]c(=O)[nH]2
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
178.147g/mol
Monoisotopic Mass:
178.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties