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89333-04-0 | Oxirane, 2-(3-chlorophenyl)-3-[(4-methylphenyl)sulfonyl]-
CAS No: 89333-04-0 Catalog No: AG003ZJV MDL No:
Product Description
Catalog Number:
AG003ZJV
Chemical Name:
Oxirane, 2-(3-chlorophenyl)-3-[(4-methylphenyl)sulfonyl]-
CAS Number:
89333-04-0
Molecular Formula:
C15H13ClO3S
Molecular Weight:
308.7799
IUPAC Name:
2-(3-chlorophenyl)-3-(4-methylphenyl)sulfonyloxirane
InChI:
InChI=1S/C15H13ClO3S/c1-10-5-7-13(8-6-10)20(17,18)15-14(19-15)11-3-2-4-12(16)9-11/h2-9,14-15H,1H3
InChI Key:
BCZHPZOYNZKQMU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)C1OC1c1cccc(c1)Cl
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.027g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.776g/mol
Monoisotopic Mass:
308.027g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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