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89317-58-8 | Quinoline, 1,2,3,4-tetrahydro-2-(4-methoxyphenyl)-1-methyl-
CAS No: 89317-58-8 Catalog No: AG0086ZD MDL No:
Product Description
Catalog Number:
AG0086ZD
Chemical Name:
Quinoline, 1,2,3,4-tetrahydro-2-(4-methoxyphenyl)-1-methyl-
CAS Number:
89317-58-8
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
2-(4-methoxyphenyl)-1-methyl-3,4-dihydro-2H-quinoline
InChI:
InChI=1S/C17H19NO/c1-18-16-6-4-3-5-13(16)9-12-17(18)14-7-10-15(19-2)11-8-14/h3-8,10-11,17H,9,12H2,1-2H3
InChI Key:
IKWFEWRYOZTOFY-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1CCc2c(N1C)cccc2
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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