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845885-63-4 | 2-Oxazolidinone,4-phenyl-3-(1,2-propadien-1-yl)-, (4S)-
CAS No: 845885-63-4 Catalog No: AG008HD3 MDL No:
Product Description
Catalog Number:
AG008HD3
Chemical Name:
2-Oxazolidinone,4-phenyl-3-(1,2-propadien-1-yl)-, (4S)-
CAS Number:
845885-63-4
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
IUPAC Name:
(4S)-4-phenyl-3-propa-1,2-dienyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C12H11NO2/c1-2-8-13-11(9-15-12(13)14)10-6-4-3-5-7-10/h3-8,11H,1,9H2/t11-/m1/s1
InChI Key:
FPCDELJNAKUUJG-LLVKDONJSA-N
SMILES:
C=C=CN1C(=O)OC[C@@H]1c1ccccc1
Properties
Complexity:
288
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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