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27825-22-5 | 2-Pyrazinecarboxamide, 3-bromo-
CAS No: 27825-22-5 Catalog No: AG002UUJ MDL No:MFCD24629009
Product Description
Catalog Number:
AG002UUJ
Chemical Name:
2-Pyrazinecarboxamide, 3-bromo-
CAS Number:
27825-22-5
Molecular Formula:
C5H4BrN3O
Molecular Weight:
202.0088
MDL Number:
MFCD24629009
IUPAC Name:
3-bromopyrazine-2-carboxamide
InChI:
InChI=1S/C5H4BrN3O/c6-4-3(5(7)10)8-1-2-9-4/h1-2H,(H2,7,10)
InChI Key:
LPDAVYRYSWZHHX-UHFFFAOYSA-N
SMILES:
NC(=O)c1nccnc1Br
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.011g/mol
Monoisotopic Mass:
200.954g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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