Home Carboxys 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylic acid

7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylic acid

CAS No.:
116993-46-5
Catalog Number:
AG01A5AP
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
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Product Description
Catalog Number:
AG01A5AP
Chemical Name:
7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylic acid
CAS Number:
116993-46-5
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
MDL Number:
MFCD00085684
IUPAC Name:
7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
InChI:
InChI=1S/C9H9NO4/c11-6-4-7(12)10-3-1-2-5(10)8(6)9(13)14/h4,11H,1-3H2,(H,13,14)
InChI Key:
UXOJMCVODLJGCP-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(O)cc(=O)n2c1CCC2
Properties
Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties