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Home > Pyridines > 878209-04-2
878209-04-2 | 2H-Azepin-2-one, 1-ethenylhexahydro-3-(4-pyridinylcarbonyl)-
CAS No: 878209-04-2 Catalog No: AG00IESE MDL No:MFCD08277149
Product Description
Catalog Number:
AG00IESE
Chemical Name:
2H-Azepin-2-one, 1-ethenylhexahydro-3-(4-pyridinylcarbonyl)-
CAS Number:
878209-04-2
MDL Number:
MFCD08277149
IUPAC Name:
1-ethenyl-3-(pyridine-4-carbonyl)azepan-2-one
InChI:
InChI=1S/C14H16N2O2/c1-2-16-10-4-3-5-12(14(16)18)13(17)11-6-8-15-9-7-11/h2,6-9,12H,1,3-5,10H2
InChI Key:
OUXUWUZGOHBWLA-UHFFFAOYSA-N
Properties
Complexity:
335
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:
0
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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