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1187171-87-4

1187171-87-4 | 3-(2,6-Dichlorobenzoyl)quinoline

CAS No: 1187171-87-4 Catalog No: AG01FEL2 MDL No:

Product Description

Catalog Number:
AG01FEL2
Chemical Name:
3-(2,6-Dichlorobenzoyl)quinoline
CAS Number:
1187171-87-4
Molecular Formula:
C16H9Cl2NO
Molecular Weight:
302.1548
IUPAC Name:
(2,6-dichlorophenyl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C16H9Cl2NO/c17-12-5-3-6-13(18)15(12)16(20)11-8-10-4-1-2-7-14(10)19-9-11/h1-9H
InChI Key:
AUYUIHSOXUIDRA-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1C(=O)c1cnc2c(c1)cccc2)Cl

Properties

Complexity:
352  
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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