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1187166-22-8 | 3-(4-Isopropoxybenzoyl)quinoline
CAS No: 1187166-22-8 Catalog No: AG01FEKI MDL No:
Product Description
Catalog Number:
AG01FEKI
Chemical Name:
3-(4-Isopropoxybenzoyl)quinoline
CAS Number:
1187166-22-8
Molecular Formula:
C19H17NO2
Molecular Weight:
291.3438
IUPAC Name:
(4-propan-2-yloxyphenyl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C19H17NO2/c1-13(2)22-17-9-7-14(8-10-17)19(21)16-11-15-5-3-4-6-18(15)20-12-16/h3-13H,1-2H3
InChI Key:
WYHMFEITXUDKMV-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C(=O)c1cnc2c(c1)cccc2)C
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.35g/mol
Monoisotopic Mass:
291.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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