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1496928-42-7 | 4-(3,5-dimethylphenyl)oxazolidin-2-one
CAS No: 1496928-42-7 Catalog No: AG01EIDO MDL No:MFCD21266229
Product Description
Catalog Number:
AG01EIDO
Chemical Name:
4-(3,5-dimethylphenyl)oxazolidin-2-one
CAS Number:
1496928-42-7
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD21266229
IUPAC Name:
4-(3,5-dimethylphenyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C11H13NO2/c1-7-3-8(2)5-9(4-7)10-6-14-11(13)12-10/h3-5,10H,6H2,1-2H3,(H,12,13)
InChI Key:
AQJSDWTVETXNQT-UHFFFAOYSA-N
SMILES:
O=C1OCC(N1)c1cc(C)cc(c1)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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