Home Aminos 5-amino-1,3-benzoxazole-2-carboxamide

5-amino-1,3-benzoxazole-2-carboxamide

CAS No.:
1525840-53-2
Catalog Number:
AG01C5CO
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
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Product Description
Catalog Number:
AG01C5CO
Chemical Name:
5-amino-1,3-benzoxazole-2-carboxamide
CAS Number:
1525840-53-2
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD30342605
IUPAC Name:
5-amino-1,3-benzoxazole-2-carboxamide
InChI:
InChI=1S/C8H7N3O2/c9-4-1-2-6-5(3-4)11-8(13-6)7(10)12/h1-3H,9H2,(H2,10,12)
InChI Key:
COVGNHJUKAMHSP-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)nc(o2)C(=O)N
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties