200,000+ products from a single source!
sales@angenechem.com
147494-03-9 | 2,3-Quinolinedicarboxylic acid, 5,7-dichloro-4-hydroxy-, 2,3-dimethyl ester
CAS No: 147494-03-9 Catalog No: AG001EXZ MDL No:
Product Description
Catalog Number:
AG001EXZ
Chemical Name:
2,3-Quinolinedicarboxylic acid, 5,7-dichloro-4-hydroxy-, 2,3-dimethyl ester
CAS Number:
147494-03-9
Molecular Formula:
C13H9Cl2NO5
Molecular Weight:
330.1203
IUPAC Name:
dimethyl 5,7-dichloro-4-oxo-1H-quinoline-2,3-dicarboxylate
InChI:
InChI=1S/C13H9Cl2NO5/c1-20-12(18)9-10(13(19)21-2)16-7-4-5(14)3-6(15)8(7)11(9)17/h3-4H,1-2H3,(H,16,17)
InChI Key:
ZIMUBONJWUJBRN-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc2cc(Cl)cc(c2c(c1C(=O)OC)O)Cl
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.986g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.117g/mol
Monoisotopic Mass:
328.986g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.