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7163-54-4 | 7,8,9,10-TETRAHYDRO-11-PHENOXY-6H-CYCLOHEPTA[B]QUINOLINE
CAS No: 7163-54-4 Catalog No: AG005RFF MDL No:
Product Description
Catalog Number:
AG005RFF
Chemical Name:
7,8,9,10-TETRAHYDRO-11-PHENOXY-6H-CYCLOHEPTA[B]QUINOLINE
CAS Number:
7163-54-4
Molecular Formula:
C20H19NO
Molecular Weight:
289.3710
IUPAC Name:
11-phenoxy-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline
InChI:
InChI=1S/C20H19NO/c1-3-9-15(10-4-1)22-20-16-11-5-2-6-13-18(16)21-19-14-8-7-12-17(19)20/h1,3-4,7-10,12,14H,2,5-6,11,13H2
InChI Key:
VHGPVVDFPDHNJF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Oc1c2CCCCCc2nc2c1cccc2
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.147g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.378g/mol
Monoisotopic Mass:
289.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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