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122916-83-0 | 2-Propanone, 1-[4-(1-methylethyl)phenyl]-1-phenyl-
CAS No: 122916-83-0 Catalog No: AG000JRQ MDL No:
Product Description
Catalog Number:
AG000JRQ
Chemical Name:
2-Propanone, 1-[4-(1-methylethyl)phenyl]-1-phenyl-
CAS Number:
122916-83-0
Molecular Formula:
C18H20O
Molecular Weight:
252.3508
IUPAC Name:
1-phenyl-1-(4-propan-2-ylphenyl)propan-2-one
InChI:
InChI=1S/C18H20O/c1-13(2)15-9-11-17(12-10-15)18(14(3)19)16-7-5-4-6-8-16/h4-13,18H,1-3H3
InChI Key:
FVQXDGHEYSUVGA-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C(c1ccccc1)C(=O)C)C
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.151g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.357g/mol
Monoisotopic Mass:
252.151g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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