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651054-44-3 | Benzoic acid, 3-[(6,7-dimethoxy-4-quinolinyl)oxy]-, methyl ester
CAS No: 651054-44-3 Catalog No: AG006SIZ MDL No:
Product Description
Catalog Number:
AG006SIZ
Chemical Name:
Benzoic acid, 3-[(6,7-dimethoxy-4-quinolinyl)oxy]-, methyl ester
CAS Number:
651054-44-3
Molecular Formula:
C19H17NO5
Molecular Weight:
339.3420
IUPAC Name:
methyl 3-(6,7-dimethoxyquinolin-4-yl)oxybenzoate
InChI:
InChI=1S/C19H17NO5/c1-22-17-10-14-15(11-18(17)23-2)20-8-7-16(14)25-13-6-4-5-12(9-13)19(21)24-3/h4-11H,1-3H3
InChI Key:
IMUIGQDOAZACTL-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)Oc1ccnc2c1cc(OC)c(c2)OC
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.111g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.347g/mol
Monoisotopic Mass:
339.111g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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