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79567-66-1 | Methanone,(6-chloro-3-pyridinyl)phenyl-
CAS No: 79567-66-1 Catalog No: AG008LWO MDL No:MFCD01754796
Product Description
Catalog Number:
AG008LWO
Chemical Name:
Methanone,(6-chloro-3-pyridinyl)phenyl-
CAS Number:
79567-66-1
Molecular Formula:
C12H8ClNO
Molecular Weight:
217.6510
MDL Number:
MFCD01754796
IUPAC Name:
(6-chloropyridin-3-yl)-phenylmethanone
InChI:
InChI=1S/C12H8ClNO/c13-11-7-6-10(8-14-11)12(15)9-4-2-1-3-5-9/h1-8H
InChI Key:
VYBSRFYWXHOQFR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cn1)C(=O)c1ccccc1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.029g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.652g/mol
Monoisotopic Mass:
217.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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