Home Carboxys 8-methoxy-3-methyl-4-oxo-1,4-dihydroquinoline-2-carboxylic acid

8-methoxy-3-methyl-4-oxo-1,4-dihydroquinoline-2-carboxylic acid

CAS No.:
55895-58-4
Catalog Number:
AG01A6W8
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
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Product Description
Catalog Number:
AG01A6W8
Chemical Name:
8-methoxy-3-methyl-4-oxo-1,4-dihydroquinoline-2-carboxylic acid
CAS Number:
55895-58-4
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
MDL Number:
MFCD19288905
IUPAC Name:
8-methoxy-3-methyl-4-oxo-1H-quinoline-2-carboxylic acid
InChI:
InChI=1S/C12H11NO4/c1-6-9(12(15)16)13-10-7(11(6)14)4-3-5-8(10)17-2/h3-5H,1-2H3,(H,13,14)(H,15,16)
InChI Key:
ZGNHIJVIWMQWPG-UHFFFAOYSA-N
SMILES:
COc1cccc2c1[nH]c(C(=O)O)c(c2=O)C
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.223g/mol
Monoisotopic Mass:
233.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties