Home Carboxys 2-Amino-1,3-benzoxazole-5-carboxylic acid

2-Amino-1,3-benzoxazole-5-carboxylic acid

CAS No.:
345958-13-6
Catalog Number:
AG00I6U2
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$275
- +
1g
95%
In Stock USA
United States
$563
- +
5g
95%
In Stock USA
United States
$1563
- +
Product Description
Catalog Number:
AG00I6U2
Chemical Name:
2-Amino-1,3-benzoxazole-5-carboxylic acid
CAS Number:
345958-13-6
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
MDL Number:
MFCD20642279
IUPAC Name:
2-amino-1,3-benzoxazole-5-carboxylic acid
InChI:
InChI=1S/C8H6N2O3/c9-8-10-5-3-4(7(11)12)1-2-6(5)13-8/h1-3H,(H2,9,10)(H,11,12)
InChI Key:
HDSPGGFTQAEPDL-UHFFFAOYSA-N
SMILES:
Nc1oc2c(n1)cc(cc2)C(=O)O
Properties
Complexity:
221  
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:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
178.147g/mol
Monoisotopic Mass:
178.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
89.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties