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131290-90-9 | 2-Propenamide, N-[(4-methylphenyl)sulfonyl]-
CAS No: 131290-90-9 Catalog No: AG000VVW MDL No:
Product Description
Catalog Number:
AG000VVW
Chemical Name:
2-Propenamide, N-[(4-methylphenyl)sulfonyl]-
CAS Number:
131290-90-9
Molecular Formula:
C10H11NO3S
Molecular Weight:
225.2642
IUPAC Name:
N-(4-methylphenyl)sulfonylprop-2-enamide
InChI:
InChI=1S/C10H11NO3S/c1-3-10(12)11-15(13,14)9-6-4-8(2)5-7-9/h3-7H,1H2,2H3,(H,11,12)
InChI Key:
MXDDRENDTSVWLG-UHFFFAOYSA-N
SMILES:
C=CC(=O)NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.046g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.262g/mol
Monoisotopic Mass:
225.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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