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89409-12-1 | Quinoline, 1-(4-chlorophenyl)-1,5,6,7-tetrahydro-2,4-diphenyl-
CAS No: 89409-12-1 Catalog No: AG003VSC MDL No:
Product Description
Catalog Number:
AG003VSC
Chemical Name:
Quinoline, 1-(4-chlorophenyl)-1,5,6,7-tetrahydro-2,4-diphenyl-
CAS Number:
89409-12-1
Molecular Formula:
C27H22ClN
Molecular Weight:
395.9233
IUPAC Name:
1-(4-chlorophenyl)-2,4-diphenyl-6,7-dihydro-5H-quinoline
InChI:
InChI=1S/C27H22ClN/c28-22-15-17-23(18-16-22)29-26-14-8-7-13-24(26)25(20-9-3-1-4-10-20)19-27(29)21-11-5-2-6-12-21/h1-6,9-12,14-19H,7-8,13H2
InChI Key:
UHHRWZCDIAZPSR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)n1c(cc(c2c1=CCCC2)c1ccccc1)c1ccccc1
Properties
Complexity:
667
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.144g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
395.93g/mol
Monoisotopic Mass:
395.144g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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