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174175-12-3 | Ethanone, 1-phenyl-2-[(S)-phenylsulfinyl]-
CAS No: 174175-12-3 Catalog No: AG001ZHN MDL No:
Product Description
Catalog Number:
AG001ZHN
Chemical Name:
Ethanone, 1-phenyl-2-[(S)-phenylsulfinyl]-
CAS Number:
174175-12-3
Molecular Formula:
C14H12O2S
Molecular Weight:
244.3089
IUPAC Name:
1-phenyl-2-[(S)-phenylsulfinyl]ethanone
InChI:
InChI=1S/C14H12O2S/c15-14(12-7-3-1-4-8-12)11-17(16)13-9-5-2-6-10-13/h1-10H,11H2/t17-/m0/s1
InChI Key:
CGSYWOFFKKJGJV-KRWDZBQOSA-N
SMILES:
O=C(c1ccccc1)C[S@](=O)c1ccccc1
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
244.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.308g/mol
Monoisotopic Mass:
244.056g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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