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169179-91-3 | 2-Oxazolidinone, 4-ethenyl-5,5-dimethyl-3-[(4-methylphenyl)sulfonyl]-
CAS No: 169179-91-3 Catalog No: AG001YIS MDL No:
Product Description
Catalog Number:
AG001YIS
Chemical Name:
2-Oxazolidinone, 4-ethenyl-5,5-dimethyl-3-[(4-methylphenyl)sulfonyl]-
CAS Number:
169179-91-3
Molecular Formula:
C14H17NO4S
Molecular Weight:
295.3541
IUPAC Name:
4-ethenyl-5,5-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C14H17NO4S/c1-5-12-14(3,4)19-13(16)15(12)20(17,18)11-8-6-10(2)7-9-11/h5-9,12H,1H2,2-4H3
InChI Key:
LBWFAKDIJNCTNW-UHFFFAOYSA-N
SMILES:
C=CC1N(C(=O)OC1(C)C)S(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
498
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.088g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.353g/mol
Monoisotopic Mass:
295.088g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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