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1187168-00-8 | 2-Chloro-5-(3-trifluoromethylbenzoyl)pyridine
CAS No: 1187168-00-8 Catalog No: AG01FA8S MDL No:
Product Description
Catalog Number:
AG01FA8S
Chemical Name:
2-Chloro-5-(3-trifluoromethylbenzoyl)pyridine
CAS Number:
1187168-00-8
Molecular Formula:
C13H7ClF3NO
Molecular Weight:
285.6490
IUPAC Name:
(6-chloropyridin-3-yl)-[3-(trifluoromethyl)phenyl]methanone
InChI:
InChI=1S/C13H7ClF3NO/c14-11-5-4-9(7-18-11)12(19)8-2-1-3-10(6-8)13(15,16)17/h1-7H
InChI Key:
HVZFAPOUXFVZBF-UHFFFAOYSA-N
SMILES:
Clc1ccc(cn1)C(=O)c1cccc(c1)C(F)(F)F
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.017g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.65g/mol
Monoisotopic Mass:
285.017g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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