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96930-27-7 | (S)-4-Benzyl-3-(3-phenylpropanoyl)oxazolidin-2-one
CAS No: 96930-27-7 Catalog No: AG006OHW MDL No:MFCD11100933
Product Description
Catalog Number:
AG006OHW
Chemical Name:
(S)-4-Benzyl-3-(3-phenylpropanoyl)oxazolidin-2-one
CAS Number:
96930-27-7
Molecular Formula:
C19H19NO3
Molecular Weight:
309.3591
MDL Number:
MFCD11100933
IUPAC Name:
(4S)-4-benzyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C19H19NO3/c21-18(12-11-15-7-3-1-4-8-15)20-17(14-23-19(20)22)13-16-9-5-2-6-10-16/h1-10,17H,11-14H2/t17-/m0/s1
InChI Key:
CDSPCWKYSYEPMH-KRWDZBQOSA-N
SMILES:
O=C(N1C(=O)OC[C@@H]1Cc1ccccc1)CCc1ccccc1
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
309.136g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.365g/mol
Monoisotopic Mass:
309.136g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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