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1187171-71-6 | 3-(2,5-Dichlorobenzoyl)quinoline
CAS No: 1187171-71-6 Catalog No: AG01FEL0 MDL No:
Product Description
Catalog Number:
AG01FEL0
Chemical Name:
3-(2,5-Dichlorobenzoyl)quinoline
CAS Number:
1187171-71-6
Molecular Formula:
C16H9Cl2NO
Molecular Weight:
302.1548
IUPAC Name:
(2,5-dichlorophenyl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C16H9Cl2NO/c17-12-5-6-14(18)13(8-12)16(20)11-7-10-3-1-2-4-15(10)19-9-11/h1-9H
InChI Key:
DHKWUCJRGUUBIU-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(=O)c1cnc2c(c1)cccc2)Cl
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.006g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.154g/mol
Monoisotopic Mass:
301.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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