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917603-82-8 | 2-Oxazolidinone, 4-methyl-4-[(1E)-3-phenyl-1-propen-1-yl]-, (4R)-
CAS No: 917603-82-8 Catalog No: AG006DKN MDL No:
Product Description
Catalog Number:
AG006DKN
Chemical Name:
2-Oxazolidinone, 4-methyl-4-[(1E)-3-phenyl-1-propen-1-yl]-, (4R)-
CAS Number:
917603-82-8
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
IUPAC Name:
(4R)-4-methyl-4-(3-phenylprop-1-enyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C13H15NO2/c1-13(10-16-12(15)14-13)9-5-8-11-6-3-2-4-7-11/h2-7,9H,8,10H2,1H3,(H,14,15)/t13-/m1/s1
InChI Key:
IXAVAYVLUMKTOA-CYBMUJFWSA-N
SMILES:
O=C1OC[C@@](N1)(C)/C=C/Cc1ccccc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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