Home Halogens 2-(4-chlorobenzoyl)pyrimidine

2-(4-chlorobenzoyl)pyrimidine

CAS No.:
64385-81-5
Catalog Number:
AG019U3J
Molecular Formula:
C11H7ClN2O
Molecular Weight:
218.6391
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Product Description
Catalog Number:
AG019U3J
Chemical Name:
2-(4-chlorobenzoyl)pyrimidine
CAS Number:
64385-81-5
Molecular Formula:
C11H7ClN2O
Molecular Weight:
218.6391
MDL Number:
MFCD00160472
IUPAC Name:
(4-chlorophenyl)-pyrimidin-2-ylmethanone
InChI:
InChI=1S/C11H7ClN2O/c12-9-4-2-8(3-5-9)10(15)11-13-6-1-7-14-11/h1-7H
InChI Key:
CQXSPCXVLBTZST-UHFFFAOYSA-N
SMILES:
O=C(c1ncccn1)c1ccc(cc1)Cl
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.025g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.64g/mol
Monoisotopic Mass:
218.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties