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568572-34-9 | 1-(2'-Methoxy-biphenyl-3-yl)-ethanone
CAS No: 568572-34-9 Catalog No: AG01EWHG MDL No:
Product Description
Catalog Number:
AG01EWHG
Chemical Name:
1-(2'-Methoxy-biphenyl-3-yl)-ethanone
CAS Number:
568572-34-9
Molecular Formula:
C15H14O2
Molecular Weight:
226.2705
IUPAC Name:
1-[3-(2-methoxyphenyl)phenyl]ethanone
InChI:
InChI=1S/C15H14O2/c1-11(16)12-6-5-7-13(10-12)14-8-3-4-9-15(14)17-2/h3-10H,1-2H3
InChI Key:
IJIOWCSKLNVBAX-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1cccc(c1)C(=O)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.099g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.275g/mol
Monoisotopic Mass:
226.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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