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132836-66-9 | 2-Oxazolidinone, 3-acetyl-4-(phenylmethyl)-, (4S)-
CAS No: 132836-66-9 Catalog No: AG00119B MDL No:MFCD00278768
Product Description
Catalog Number:
AG00119B
Chemical Name:
2-Oxazolidinone, 3-acetyl-4-(phenylmethyl)-, (4S)-
CAS Number:
132836-66-9
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
MDL Number:
MFCD00278768
IUPAC Name:
(4S)-3-acetyl-4-benzyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C12H13NO3/c1-9(14)13-11(8-16-12(13)15)7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3/t11-/m0/s1
InChI Key:
YMVGXIZVSPMNPD-NSHDSACASA-N
SMILES:
CC(=O)N1C(=O)OC[C@@H]1Cc1ccccc1
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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