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919290-05-4 | Butanamide, 2-(2-oxazolidinylidene)-3-oxo-N-phenyl-
CAS No: 919290-05-4 Catalog No: AG0067D9 MDL No:
Product Description
Catalog Number:
AG0067D9
Chemical Name:
Butanamide, 2-(2-oxazolidinylidene)-3-oxo-N-phenyl-
CAS Number:
919290-05-4
Molecular Formula:
C13H14N2O3
Molecular Weight:
246.2619
IUPAC Name:
2-(1,3-oxazolidin-2-ylidene)-3-oxo-N-phenylbutanamide
InChI:
InChI=1S/C13H14N2O3/c1-9(16)11(13-14-7-8-18-13)12(17)15-10-5-3-2-4-6-10/h2-6,14H,7-8H2,1H3,(H,15,17)
InChI Key:
UPBJDVAFABYDCS-UHFFFAOYSA-N
SMILES:
O=C(C(=C1NCCO1)C(=O)C)Nc1ccccc1
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
246.266g/mol
Monoisotopic Mass:
246.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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