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97857-95-9 | 2-Oxazolidinone, 5-[1,1'-biphenyl]-4-yl-4-methyl-, cis-
CAS No: 97857-95-9 Catalog No: AG005XPE MDL No:
Product Description
Catalog Number:
AG005XPE
Chemical Name:
2-Oxazolidinone, 5-[1,1'-biphenyl]-4-yl-4-methyl-, cis-
CAS Number:
97857-95-9
Molecular Formula:
C16H15NO2
Molecular Weight:
253.2958
IUPAC Name:
4-methyl-5-(4-phenylphenyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C16H15NO2/c1-11-15(19-16(18)17-11)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11,15H,1H3,(H,17,18)
InChI Key:
CTGDSDPUFYMRDO-UHFFFAOYSA-N
SMILES:
O=C1O[C@@H]([C@@H](N1)C)c1ccc(cc1)c1ccccc1
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.301g/mol
Monoisotopic Mass:
253.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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