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85239-19-6 | 1-Piperidineethanol, a-[(8-quinolinyloxy)methyl]-
CAS No: 85239-19-6 Catalog No: AG004PTW MDL No:
Product Description
Catalog Number:
AG004PTW
Chemical Name:
1-Piperidineethanol, a-[(8-quinolinyloxy)methyl]-
CAS Number:
85239-19-6
Molecular Formula:
C17H22N2O2
Molecular Weight:
286.3688
IUPAC Name:
1-piperidin-1-yl-3-quinolin-8-yloxypropan-2-ol
InChI:
InChI=1S/C17H22N2O2/c20-15(12-19-10-2-1-3-11-19)13-21-16-8-4-6-14-7-5-9-18-17(14)16/h4-9,15,20H,1-3,10-13H2
InChI Key:
AVHSALUZPKEFJX-UHFFFAOYSA-N
SMILES:
OC(CN1CCCCC1)COc1cccc2c1nccc2
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.168g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.375g/mol
Monoisotopic Mass:
286.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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