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88741-25-7 | 2-Pentenamide, 2-[1-(methylimino)ethyl]-4-oxo-N-phenyl-
CAS No: 88741-25-7 Catalog No: AG004E1C MDL No:
Product Description
Catalog Number:
AG004E1C
Chemical Name:
2-Pentenamide, 2-[1-(methylimino)ethyl]-4-oxo-N-phenyl-
CAS Number:
88741-25-7
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
IUPAC Name:
2-(C,N-dimethylcarbonimidoyl)-4-oxo-N-phenylpent-2-enamide
InChI:
InChI=1S/C14H16N2O2/c1-10(17)9-13(11(2)15-3)14(18)16-12-7-5-4-6-8-12/h4-9H,1-3H3,(H,16,18)
InChI Key:
XMAALXLZBVBNQJ-UHFFFAOYSA-N
SMILES:
CN=C(C(=CC(=O)C)C(=O)Nc1ccccc1)C
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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