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16795-34-9 | 2-Propen-1-one, 3-(4-chlorophenyl)-1-(3-pyridinyl)-
CAS No: 16795-34-9 Catalog No: AG001XPV MDL No:
Product Description
Catalog Number:
AG001XPV
Chemical Name:
2-Propen-1-one, 3-(4-chlorophenyl)-1-(3-pyridinyl)-
CAS Number:
16795-34-9
Molecular Formula:
C14H10ClNO
Molecular Weight:
243.6883
IUPAC Name:
3-(4-chlorophenyl)-1-pyridin-3-ylprop-2-en-1-one
InChI:
InChI=1S/C14H10ClNO/c15-13-6-3-11(4-7-13)5-8-14(17)12-2-1-9-16-10-12/h1-10H
InChI Key:
FSCXVFQUEGRJLW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C=CC(=O)c1cccnc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.045g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.69g/mol
Monoisotopic Mass:
243.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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