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1196151-53-7

1196151-53-7 | 2-Pyrazinecarboxylic acid, 6-bromo-

CAS No: 1196151-53-7 Catalog No: AG000PAI MDL No:MFCD13190200

Product Description

Catalog Number:
AG000PAI
Chemical Name:
2-Pyrazinecarboxylic acid, 6-bromo-
CAS Number:
1196151-53-7
Molecular Formula:
C5H3BrN2O2
Molecular Weight:
202.9935
MDL Number:
MFCD13190200
IUPAC Name:
6-bromopyrazine-2-carboxylic acid
InChI:
InChI=1S/C5H3BrN2O2/c6-4-2-7-1-3(8-4)5(9)10/h1-2H,(H,9,10)
InChI Key:
HKGHXDMQMSAZSQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(n1)Br

Properties

Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.938g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.995g/mol
Monoisotopic Mass:
201.938g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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