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83716-65-8 | 2-Propenamide, 3-(2-methylphenyl)-
CAS No: 83716-65-8 Catalog No: AG004T6A MDL No:
Product Description
Catalog Number:
AG004T6A
Chemical Name:
2-Propenamide, 3-(2-methylphenyl)-
CAS Number:
83716-65-8
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
3-(2-methylphenyl)prop-2-enamide
InChI:
InChI=1S/C10H11NO/c1-8-4-2-3-5-9(8)6-7-10(11)12/h2-7H,1H3,(H2,11,12)
InChI Key:
GLJWZMYXVRYLPB-UHFFFAOYSA-N
SMILES:
NC(=O)C=Cc1ccccc1C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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