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132490-25-6 | Methanone, (4-methylphenyl)[(2R,3S)-3-phenyl-2-oxiranyl]-
CAS No: 132490-25-6 Catalog No: AG0010QE MDL No:
Product Description
Catalog Number:
AG0010QE
Chemical Name:
Methanone, (4-methylphenyl)[(2R,3S)-3-phenyl-2-oxiranyl]-
CAS Number:
132490-25-6
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
IUPAC Name:
(4-methylphenyl)-(3-phenyloxiran-2-yl)methanone
InChI:
InChI=1S/C16H14O2/c1-11-7-9-12(10-8-11)14(17)16-15(18-16)13-5-3-2-4-6-13/h2-10,15-16H,1H3
InChI Key:
XMLFNFVRQZKLTI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)[C@@H]1O[C@H]1c1ccccc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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