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26228-11-5 | 2-Propenamide, 3-(4-butoxy-3-methylphenyl)-N-hydroxy-
CAS No: 26228-11-5 Catalog No: AG002SCS MDL No:
Product Description
Catalog Number:
AG002SCS
Chemical Name:
2-Propenamide, 3-(4-butoxy-3-methylphenyl)-N-hydroxy-
CAS Number:
26228-11-5
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
IUPAC Name:
(E)-3-(4-butoxy-3-methylphenyl)-N-hydroxyprop-2-enamide
InChI:
InChI=1S/C14H19NO3/c1-3-4-9-18-13-7-5-12(10-11(13)2)6-8-14(16)15-17/h5-8,10,17H,3-4,9H2,1-2H3,(H,15,16)/b8-6+
InChI Key:
MPNVSKLDSKNFBT-SOFGYWHQSA-N
SMILES:
CCCCOc1ccc(cc1C)C=CC(=O)NO
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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