Home Carboxys 1H-Imidazole-2-carboxylic acid, 5-amino-

1H-Imidazole-2-carboxylic acid, 5-amino-

CAS No.:
155815-92-2
Catalog Number:
AG001O90
Molecular Formula:
C4H5N3O2
Molecular Weight:
127.1014
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Product Description
Catalog Number:
AG001O90
Chemical Name:
1H-Imidazole-2-carboxylic acid, 5-amino-
CAS Number:
155815-92-2
Molecular Formula:
C4H5N3O2
Molecular Weight:
127.1014
MDL Number:
MFCD00984820
IUPAC Name:
5-amino-1H-imidazole-2-carboxylic acid
InChI:
InChI=1S/C4H5N3O2/c5-2-1-6-3(7-2)4(8)9/h1H,5H2,(H,6,7)(H,8,9)
InChI Key:
RFOFSMYXSBHWPC-UHFFFAOYSA-N
SMILES:
Nc1cnc([nH]1)C(=O)O
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.038g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
127.103g/mol
Monoisotopic Mass:
127.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties