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104266-89-9 | (S)-4-Benzyl-3-(2-phenylacetyl)oxazolidin-2-one
CAS No: 104266-89-9 Catalog No: AG007Y96 MDL No:
Product Description
Catalog Number:
AG007Y96
Chemical Name:
(S)-4-Benzyl-3-(2-phenylacetyl)oxazolidin-2-one
CAS Number:
104266-89-9
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
IUPAC Name:
(4S)-4-benzyl-3-(2-phenylacetyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C18H17NO3/c20-17(12-15-9-5-2-6-10-15)19-16(13-22-18(19)21)11-14-7-3-1-4-8-14/h1-10,16H,11-13H2/t16-/m0/s1
InChI Key:
AQFHLFHMTNGCPQ-INIZCTEOSA-N
SMILES:
O=C(N1C(=O)OC[C@@H]1Cc1ccccc1)Cc1ccccc1
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
295.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.338g/mol
Monoisotopic Mass:
295.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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