sodium;4-methoxycarbonyl-5,5-dimethyl-3-oxo-2-[(E)-N-prop-2-enoxy-C-propylcarbonimidoyl]cyclohexen-1-olate


Chemical Name: sodium;4-methoxycarbonyl-5,5-dimethyl-3-oxo-2-[(E)-N-prop-2-enoxy-C-propylcarbonimidoyl]cyclohexen-1-olate
CAS Number: 55635-13-7
Product Number: AG00DESF(AGN-PC-042YZP)
Synonyms:
MDL No:
Molecular Formula: C17H24NNaO5
Molecular Weight: 345.36593

Identification/Properties


Computed Properties
Molecular Weight:
345.371g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
8
Exact Mass:
345.155g/mol
Monoisotopic Mass:
345.155g/mol
Topological Polar Surface Area:
88A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
551
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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