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1187169-18-1 | 4-(2,4-Dichlorobenzoyl)-2-methylpyridine
CAS No: 1187169-18-1 Catalog No: AG01FBVE MDL No:
Product Description
Catalog Number:
AG01FBVE
Chemical Name:
4-(2,4-Dichlorobenzoyl)-2-methylpyridine
CAS Number:
1187169-18-1
Molecular Formula:
C13H9Cl2NO
Molecular Weight:
266.1227
IUPAC Name:
(2,4-dichlorophenyl)-(2-methylpyridin-4-yl)methanone
InChI:
InChI=1S/C13H9Cl2NO/c1-8-6-9(4-5-16-8)13(17)11-3-2-10(14)7-12(11)15/h2-7H,1H3
InChI Key:
SAMSDJFWZXDQGL-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)C(=O)c1ccnc(c1)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.006g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.121g/mol
Monoisotopic Mass:
265.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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