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Home > Bromides > 1222997-48-9
1222997-48-9 | 4H-Pyrido[1,2-a]pyrimidin-4-one, 9-bromo-7-chloro-
CAS No: 1222997-48-9 Catalog No: AG00172A MDL No:
Product Description
Catalog Number:
AG00172A
Chemical Name:
4H-Pyrido[1,2-a]pyrimidin-4-one, 9-bromo-7-chloro-
CAS Number:
1222997-48-9
Molecular Formula:
C8H4BrClN2O
Molecular Weight:
259.4872
IUPAC Name:
9-bromo-7-chloropyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C8H4BrClN2O/c9-6-3-5(10)4-12-7(13)1-2-11-8(6)12/h1-4H
InChI Key:
GJBSAYPPZFSSDM-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c2n(c1)c(=O)ccn2
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.92g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.487g/mol
Monoisotopic Mass:
257.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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