Home Halogens 7-bromo-2-(chloromethyl)-4H-pyrido[1,2-a]pyrimidin-4-one

7-bromo-2-(chloromethyl)-4H-pyrido[1,2-a]pyrimidin-4-one

CAS No.:
442531-33-1
Catalog Number:
AG00DJ3W
Molecular Formula:
C9H6BrClN2O
Molecular Weight:
273.5137
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Product Description
Catalog Number:
AG00DJ3W
Chemical Name:
7-bromo-2-(chloromethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CAS Number:
442531-33-1
Molecular Formula:
C9H6BrClN2O
Molecular Weight:
273.5137
MDL Number:
MFCD02656547
IUPAC Name:
7-bromo-2-(chloromethyl)pyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C9H6BrClN2O/c10-6-1-2-8-12-7(4-11)3-9(14)13(8)5-6/h1-3,5H,4H2
InChI Key:
HKULCEKJGGNDSO-UHFFFAOYSA-N
SMILES:
ClCc1cc(=O)n2c(n1)ccc(c2)Br
Properties
Complexity:
409  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.935g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.514g/mol
Monoisotopic Mass:
271.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties