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15762-17-1 | 2-Propanone, 1,3-bis([1,1'-biphenyl]-4-yl)-
CAS No: 15762-17-1 Catalog No: AG001PKP MDL No:
Product Description
Catalog Number:
AG001PKP
Chemical Name:
2-Propanone, 1,3-bis([1,1'-biphenyl]-4-yl)-
CAS Number:
15762-17-1
Molecular Formula:
C27H22O
Molecular Weight:
362.4630
IUPAC Name:
1,3-bis(4-phenylphenyl)propan-2-one
InChI:
InChI=1S/C27H22O/c28-27(19-21-11-15-25(16-12-21)23-7-3-1-4-8-23)20-22-13-17-26(18-14-22)24-9-5-2-6-10-24/h1-18H,19-20H2
InChI Key:
YKUZSFRQDRMMJV-UHFFFAOYSA-N
SMILES:
O=C(Cc1ccc(cc1)c1ccccc1)Cc1ccc(cc1)c1ccccc1
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.167g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.472g/mol
Monoisotopic Mass:
362.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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