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124491-44-7

124491-44-7 | 5-Pyrimidinecarbonyl bromide, 2-amino-

CAS No: 124491-44-7 Catalog No: AG000M2H MDL No:

Product Description

Catalog Number:
AG000M2H
Chemical Name:
5-Pyrimidinecarbonyl bromide, 2-amino-
CAS Number:
124491-44-7
Molecular Formula:
C5H4BrN3O
Molecular Weight:
202.0088
IUPAC Name:
2-aminopyrimidine-5-carbonyl bromide
InChI:
InChI=1S/C5H4BrN3O/c6-4(10)3-1-8-5(7)9-2-3/h1-2H,(H2,7,8,9)
InChI Key:
XKYSQBJCKBYAHV-UHFFFAOYSA-N
SMILES:
BrC(=O)c1cnc(nc1)N

Properties

Complexity:
133  
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:
4  
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:
0.4  

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