1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-2-(4-pyridinylmethylene)-


Chemical Name: 1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-2-(4-pyridinylmethylene)-
CAS Number: 4803-74-1
Product Number: AG00IMLW(AGN-PC-00BUO5)
Synonyms:
MDL No:
Molecular Formula: C17H15NO3
Molecular Weight: 281.3059

Identification/Properties


Computed Properties
Molecular Weight:
281.311g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
281.105g/mol
Monoisotopic Mass:
281.105g/mol
Topological Polar Surface Area:
48.4A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
414
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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