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1170163-05-9 | Piperidine, 2-[(3-ethoxyphenyl)methyl]-, hydrochloride (1:1)
CAS No: 1170163-05-9 Catalog No: AG000DK8 MDL No:
Product Description
Catalog Number:
AG000DK8
Chemical Name:
Piperidine, 2-[(3-ethoxyphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1170163-05-9
Molecular Formula:
C14H22ClNO
Molecular Weight:
255.7836
IUPAC Name:
2-[(3-ethoxyphenyl)methyl]piperidine;hydrochloride
InChI:
InChI=1S/C14H21NO.ClH/c1-2-16-14-8-5-6-12(11-14)10-13-7-3-4-9-15-13;/h5-6,8,11,13,15H,2-4,7,9-10H2,1H3;1H
InChI Key:
NPUGUBDDXXIXLP-UHFFFAOYSA-N
SMILES:
CCOc1cccc(c1)CC1CCCCN1.Cl
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.139g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.786g/mol
Monoisotopic Mass:
255.139g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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