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1187171-88-5 | 3-(2,3-Dimethoxybenzoyl)quinoline
CAS No: 1187171-88-5 Catalog No: AG01FEBI MDL No:
Product Description
Catalog Number:
AG01FEBI
Chemical Name:
3-(2,3-Dimethoxybenzoyl)quinoline
CAS Number:
1187171-88-5
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
IUPAC Name:
(2,3-dimethoxyphenyl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C18H15NO3/c1-21-16-9-5-7-14(18(16)22-2)17(20)13-10-12-6-3-4-8-15(12)19-11-13/h3-11H,1-2H3
InChI Key:
SVYKVVDNOAVCLF-UHFFFAOYSA-N
SMILES:
COc1c(OC)cccc1C(=O)c1cnc2c(c1)cccc2
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.322g/mol
Monoisotopic Mass:
293.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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