9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxylic acid


Chemical Name: 9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxylic acid
CAS Number: 104239-97-6
Product Number: AG008RBC(AGN-PC-0007CW)
Synonyms:
MDL No:
Molecular Formula: C19H27NO3
Molecular Weight: 317.4226

Identification/Properties


Computed Properties
Molecular Weight:
317.429g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
317.199g/mol
Monoisotopic Mass:
317.199g/mol
Topological Polar Surface Area:
66.4A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
585
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
7
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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