Home Carboxys 1,3-dimethyl-2-oxo-1,2-dihydroquinoline-4-carboxylic acid

1,3-dimethyl-2-oxo-1,2-dihydroquinoline-4-carboxylic acid

CAS No.:
1073071-78-9
Catalog Number:
AG01CA9L
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
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Product Description
Catalog Number:
AG01CA9L
Chemical Name:
1,3-dimethyl-2-oxo-1,2-dihydroquinoline-4-carboxylic acid
CAS Number:
1073071-78-9
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
MDL Number:
MFCD24499224
IUPAC Name:
1,3-dimethyl-2-oxoquinoline-4-carboxylic acid
InChI:
InChI=1S/C12H11NO3/c1-7-10(12(15)16)8-5-3-4-6-9(8)13(2)11(7)14/h3-6H,1-2H3,(H,15,16)
InChI Key:
CHMGVNDZWOYOEJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)c(=O)n(c2c1cccc2)C
Properties
Complexity:
373  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties