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184784-56-3 | 2-Oxazolidinone, 3-[(2E)-4-methyl-1-oxo-2-pentenyl]-4-phenyl-, (4S)-
CAS No: 184784-56-3 Catalog No: AG0074X8 MDL No:
Product Description
Catalog Number:
AG0074X8
Chemical Name:
2-Oxazolidinone, 3-[(2E)-4-methyl-1-oxo-2-pentenyl]-4-phenyl-, (4S)-
CAS Number:
184784-56-3
Molecular Formula:
C15H17NO3
Molecular Weight:
259.3004
IUPAC Name:
(4S)-3-(4-methylpent-2-enoyl)-4-phenyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C15H17NO3/c1-11(2)8-9-14(17)16-13(10-19-15(16)18)12-6-4-3-5-7-12/h3-9,11,13H,10H2,1-2H3/t13-/m1/s1
InChI Key:
BJWQPTYUJPHCFC-CYBMUJFWSA-N
SMILES:
CC(/C=C/C(=O)N1C(=O)OC[C@@H]1c1ccccc1)C
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
259.121g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.305g/mol
Monoisotopic Mass:
259.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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