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89332-99-0 | Oxirane, 2-(4-chlorophenyl)-3-(phenylsulfonyl)-
CAS No: 89332-99-0 Catalog No: AG003ZJX MDL No:
Product Description
Catalog Number:
AG003ZJX
Chemical Name:
Oxirane, 2-(4-chlorophenyl)-3-(phenylsulfonyl)-
CAS Number:
89332-99-0
Molecular Formula:
C14H11ClO3S
Molecular Weight:
294.7533
IUPAC Name:
2-(benzenesulfonyl)-3-(4-chlorophenyl)oxirane
InChI:
InChI=1S/C14H11ClO3S/c15-11-8-6-10(7-9-11)13-14(18-13)19(16,17)12-4-2-1-3-5-12/h1-9,13-14H
InChI Key:
RKHAFMLOUBZINW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C1OC1S(=O)(=O)c1ccccc1
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.012g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.749g/mol
Monoisotopic Mass:
294.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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