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89080-82-0 | Quinoline, 2,4-dimethoxy-3-(2-methylphenyl)-
CAS No: 89080-82-0 Catalog No: AG003ZP9 MDL No:
Product Description
Catalog Number:
AG003ZP9
Chemical Name:
Quinoline, 2,4-dimethoxy-3-(2-methylphenyl)-
CAS Number:
89080-82-0
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
IUPAC Name:
2,4-dimethoxy-3-(2-methylphenyl)quinoline
InChI:
InChI=1S/C18H17NO2/c1-12-8-4-5-9-13(12)16-17(20-2)14-10-6-7-11-15(14)19-18(16)21-3/h4-11H,1-3H3
InChI Key:
SJFHLJHMEGDQLP-UHFFFAOYSA-N
SMILES:
COc1nc2ccccc2c(c1c1ccccc1C)OC
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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