Home Halogens 3-bromo-1-methyl-1,2-dihydropyrazin-2-one

3-bromo-1-methyl-1,2-dihydropyrazin-2-one

CAS No.:
1187017-25-9
Catalog Number:
AG01AJPL
Molecular Formula:
C5H5BrN2O
Molecular Weight:
189.0100
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Product Description
Catalog Number:
AG01AJPL
Chemical Name:
3-bromo-1-methyl-1,2-dihydropyrazin-2-one
CAS Number:
1187017-25-9
Molecular Formula:
C5H5BrN2O
Molecular Weight:
189.0100
MDL Number:
MFCD17250183
IUPAC Name:
3-bromo-1-methylpyrazin-2-one
InChI:
InChI=1S/C5H5BrN2O/c1-8-3-2-7-4(6)5(8)9/h2-3H,1H3
InChI Key:
AUYAZFFUBLQLGL-UHFFFAOYSA-N
SMILES:
Cn1ccnc(c1=O)Br
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.959g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.012g/mol
Monoisotopic Mass:
187.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties