Name: Name:3-Quinolinecarboxylic acid, 1,2-dihydro-4-hydroxy-5-Methoxy-1-Methyl-2-oxo-
Brand: Angene
SKU: AG00BF1A
Rating: 90 (10 reviews)

3-Quinolinecarboxylic acid, 1,2-dihydro-4-hydroxy-5-Methoxy-1-Methyl-2-oxo-

CAS No.:

248282-18-0

Catalog Number:

AG00BF1A

Molecular Formula:

C12H11NO5

Molecular Weight:

249.2194

Catalog Number:

AG00BF1A

Chemical Name:

3-Quinolinecarboxylic acid, 1,2-dihydro-4-hydroxy-5-Methoxy-1-Methyl-2-oxo-

CAS Number:

248282-18-0

Molecular Formula:

C12H11NO5

Molecular Weight:

249.2194

MDL Number:

MFCD20268111

IUPAC Name:

4-hydroxy-5-methoxy-1-methyl-2-oxoquinoline-3-carboxylic acid

InChI:

InChI=1S/C12H11NO5/c1-13-6-4-3-5-7(18-2)8(6)10(14)9(11(13)15)12(16)17/h3-5,14H,1-2H3,(H,16,17)

InChI Key:

NAHJLLJQGJMMRD-UHFFFAOYSA-N

SMILES:

COc1cccc2c1c(O)c(C(=O)O)c(=O)n2C

Complexity:

417

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.222g/mol

Monoisotopic Mass:

249.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7