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893739-17-8 | 1-(4'-Chloro-[1,1'-biphenyl]-2-yl)ethanone
CAS No: 893739-17-8 Catalog No: AG003WGE MDL No:MFCD06802700
Product Description
Catalog Number:
AG003WGE
Chemical Name:
1-(4'-Chloro-[1,1'-biphenyl]-2-yl)ethanone
CAS Number:
893739-17-8
Molecular Formula:
C14H11ClO
Molecular Weight:
230.6895
MDL Number:
MFCD06802700
IUPAC Name:
1-[2-(4-chlorophenyl)phenyl]ethanone
InChI:
InChI=1S/C14H11ClO/c1-10(16)13-4-2-3-5-14(13)11-6-8-12(15)9-7-11/h2-9H,1H3
InChI Key:
JMXLTGKPGGITEG-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1ccccc1C(=O)C
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.05g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.691g/mol
Monoisotopic Mass:
230.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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