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86286-50-2 | (4R,5S)-cis-4,5-Diphenyloxazolidin-2-one
CAS No: 86286-50-2 Catalog No: AG004JGV MDL No:MFCD00674023
Product Description
Catalog Number:
AG004JGV
Chemical Name:
(4R,5S)-cis-4,5-Diphenyloxazolidin-2-one
CAS Number:
86286-50-2
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
MDL Number:
MFCD00674023
IUPAC Name:
(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C15H13NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10,13-14H,(H,16,17)/t13-,14+/m1/s1
InChI Key:
LTENIVFVXMCOQI-KGLIPLIRSA-N
SMILES:
O=C1N[C@@H]([C@@H](O1)c1ccccc1)c1ccccc1
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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