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19831-39-1

19831-39-1 | Piperidine, 1-[2-(hexyloxy)-2-phenylethyl]-, hydrochloride (1:1)

CAS No: 19831-39-1 Catalog No: AG002BFW MDL No:

Product Description

Catalog Number:
AG002BFW
Chemical Name:
Piperidine, 1-[2-(hexyloxy)-2-phenylethyl]-, hydrochloride (1:1)
CAS Number:
19831-39-1
Molecular Formula:
C19H32ClNO
Molecular Weight:
325.9165
IUPAC Name:
1-(2-hexoxy-2-phenylethyl)piperidine;hydrochloride
InChI:
InChI=1S/C19H31NO.ClH/c1-2-3-4-11-16-21-19(18-12-7-5-8-13-18)17-20-14-9-6-10-15-20;/h5,7-8,12-13,19H,2-4,6,9-11,14-17H2,1H3;1H
InChI Key:
KDIWNTCAJFHQOO-UHFFFAOYSA-N
SMILES:
CCCCCCOC(c1ccccc1)CN1CCCCC1.Cl

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.217g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
325.921g/mol
Monoisotopic Mass:
325.217g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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