Home Carboxys 3-oxo-2,3,5,6,7,8-hexahydrocinnoline-6-carboxylic acid

3-oxo-2,3,5,6,7,8-hexahydrocinnoline-6-carboxylic acid

CAS No.:
1708264-02-1
Catalog Number:
AG01E7LV
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01E7LV
Chemical Name:
3-oxo-2,3,5,6,7,8-hexahydrocinnoline-6-carboxylic acid
CAS Number:
1708264-02-1
MDL Number:
MFCD27974896
IUPAC Name:
3-oxo-5,6,7,8-tetrahydro-2H-cinnoline-6-carboxylic acid
InChI:
InChI=1S/C9H10N2O3/c12-8-4-6-3-5(9(13)14)1-2-7(6)10-11-8/h4-5H,1-3H2,(H,11,12)(H,13,14)
InChI Key:
FGJSPPZYTZASKN-UHFFFAOYSA-N
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.19g/mol
Monoisotopic Mass:
194.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties