Home Other Building Blocks 4-OXO-1,2,3,4-TETRAHYDROQUINOLINE-5-CARBOXYLIC ACID

4-OXO-1,2,3,4-TETRAHYDROQUINOLINE-5-CARBOXYLIC ACID

CAS No.:
1391287-16-3
Catalog Number:
AG01DVZU
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
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Product Description
Catalog Number:
AG01DVZU
Chemical Name:
4-OXO-1,2,3,4-TETRAHYDROQUINOLINE-5-CARBOXYLIC ACID
CAS Number:
1391287-16-3
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD22426001
IUPAC Name:
4-oxo-2,3-dihydro-1H-quinoline-5-carboxylic acid
InChI:
InChI=1S/C10H9NO3/c12-8-4-5-11-7-3-1-2-6(9(7)8)10(13)14/h1-3,11H,4-5H2,(H,13,14)
InChI Key:
LPWBLDPEQCXHBN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1C(=O)CCN2
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties