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169179-88-8 | 2-Oxazolidinone, 4-ethenyl-3-[(4-methylphenyl)sulfonyl]-
CAS No: 169179-88-8 Catalog No: AG001YIT MDL No:
Product Description
Catalog Number:
AG001YIT
Chemical Name:
2-Oxazolidinone, 4-ethenyl-3-[(4-methylphenyl)sulfonyl]-
CAS Number:
169179-88-8
Molecular Formula:
C12H13NO4S
Molecular Weight:
267.3009
IUPAC Name:
4-ethenyl-3-(4-methylphenyl)sulfonyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C12H13NO4S/c1-3-10-8-17-12(14)13(10)18(15,16)11-6-4-9(2)5-7-11/h3-7,10H,1,8H2,2H3
InChI Key:
HBQKWXYWJQVRSH-UHFFFAOYSA-N
SMILES:
C=CC1COC(=O)N1S(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.057g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.299g/mol
Monoisotopic Mass:
267.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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