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26327-83-3 | Piperidine, 1-[3-[2-(4-chlorophenoxy)phenoxy]propyl]-, hydrochloride (1:1)
CAS No: 26327-83-3 Catalog No: AG002SR9 MDL No:
Product Description
Catalog Number:
AG002SR9
Chemical Name:
Piperidine, 1-[3-[2-(4-chlorophenoxy)phenoxy]propyl]-, hydrochloride (1:1)
CAS Number:
26327-83-3
Molecular Formula:
C20H25Cl2NO2
Molecular Weight:
382.3240
IUPAC Name:
1-[3-[2-(4-chlorophenoxy)phenoxy]propyl]piperidine;hydrochloride
InChI:
InChI=1S/C20H24ClNO2.ClH/c21-17-9-11-18(12-10-17)24-20-8-3-2-7-19(20)23-16-6-15-22-13-4-1-5-14-22;/h2-3,7-12H,1,4-6,13-16H2;1H
InChI Key:
ZRLGAOQIOUCRIO-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Oc1ccccc1OCCCN1CCCCC1.Cl
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
382.325g/mol
Monoisotopic Mass:
381.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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