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1823952-84-6

1823952-84-6 | 1H-Imidazole-2-carboxamide, 5-bromo-

CAS No: 1823952-84-6 Catalog No: AG0023TO MDL No:

Product Description

Catalog Number:
AG0023TO
Chemical Name:
1H-Imidazole-2-carboxamide, 5-bromo-
CAS Number:
1823952-84-6
Molecular Formula:
C4H4BrN3O
Molecular Weight:
189.9981
IUPAC Name:
5-bromo-1H-imidazole-2-carboxamide
InChI:
InChI=1S/C4H4BrN3O/c5-2-1-7-4(8-2)3(6)9/h1H,(H2,6,9)(H,7,8)
InChI Key:
CWUROIGURLVKRG-UHFFFAOYSA-N
SMILES:
NC(=O)c1ncc([nH]1)Br

Properties

Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.954g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190g/mol
Monoisotopic Mass:
188.954g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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