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872452-03-4 | Acetamide,N-[1-(6-methyl-2-oxo-2H-pyran-4-yl)ethenyl]-
CAS No: 872452-03-4 Catalog No: AG004R2D MDL No:
Product Description
Catalog Number:
AG004R2D
Chemical Name:
Acetamide,N-[1-(6-methyl-2-oxo-2H-pyran-4-yl)ethenyl]-
CAS Number:
872452-03-4
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
IUPAC Name:
N-[1-(2-methyl-6-oxopyran-4-yl)ethenyl]acetamide
InChI:
InChI=1S/C10H11NO3/c1-6-4-9(5-10(13)14-6)7(2)11-8(3)12/h4-5H,2H2,1,3H3,(H,11,12)
InChI Key:
DYJNKYOEIYTQGX-UHFFFAOYSA-N
SMILES:
CC(=O)NC(=C)c1cc(C)oc(=O)c1
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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