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144536-59-4 | Cyclohexanone, 2-methyl-6-(2-oxo-2-phenylethyl)-
CAS No: 144536-59-4 Catalog No: AG001JQ1 MDL No:
Product Description
Catalog Number:
AG001JQ1
Chemical Name:
Cyclohexanone, 2-methyl-6-(2-oxo-2-phenylethyl)-
CAS Number:
144536-59-4
Molecular Formula:
C15H18O2
Molecular Weight:
230.3022
IUPAC Name:
2-methyl-6-phenacylcyclohexan-1-one
InChI:
InChI=1S/C15H18O2/c1-11-6-5-9-13(15(11)17)10-14(16)12-7-3-2-4-8-12/h2-4,7-8,11,13H,5-6,9-10H2,1H3
InChI Key:
WGZQXOVFBRWNKV-UHFFFAOYSA-N
SMILES:
CC1CCCC(C1=O)CC(=O)c1ccccc1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.131g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.307g/mol
Monoisotopic Mass:
230.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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