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168297-96-9

168297-96-9 | 2-Oxazolidinone, 5,5-dimethyl-3-(1-oxo-3-phenylpropyl)-4-phenyl-, (4S)-

CAS No: 168297-96-9 Catalog No: AG001XZR MDL No:

Product Description

Catalog Number:
AG001XZR
Chemical Name:
2-Oxazolidinone, 5,5-dimethyl-3-(1-oxo-3-phenylpropyl)-4-phenyl-, (4S)-
CAS Number:
168297-96-9
Molecular Formula:
C20H21NO3
Molecular Weight:
323.3856
IUPAC Name:
(4S)-5,5-dimethyl-4-phenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C20H21NO3/c1-20(2)18(16-11-7-4-8-12-16)21(19(23)24-20)17(22)14-13-15-9-5-3-6-10-15/h3-12,18H,13-14H2,1-2H3/t18-/m0/s1
InChI Key:
QQKWYERZMUDKRS-SFHVURJKSA-N
SMILES:
O=C(N1C(=O)OC([C@@H]1c1ccccc1)(C)C)CCc1ccccc1

Properties

Complexity:
462  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
323.152g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.392g/mol
Monoisotopic Mass:
323.152g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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