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1224097-13-5 | Piperidine, 1-cyclohexyl-4-(phenylmethyl)-, hydrochloride (1:1)
CAS No: 1224097-13-5 Catalog No: AG001774 MDL No:
Product Description
Catalog Number:
AG001774
Chemical Name:
Piperidine, 1-cyclohexyl-4-(phenylmethyl)-, hydrochloride (1:1)
CAS Number:
1224097-13-5
Molecular Formula:
C18H28ClN
Molecular Weight:
293.8746
IUPAC Name:
4-benzyl-1-cyclohexylpiperidine;hydrochloride
InChI:
InChI=1S/C18H27N.ClH/c1-3-7-16(8-4-1)15-17-11-13-19(14-12-17)18-9-5-2-6-10-18;/h1,3-4,7-8,17-18H,2,5-6,9-15H2;1H
InChI Key:
QQQJUFOLSGCMDF-UHFFFAOYSA-N
SMILES:
C1CCC(CC1)N1CCC(CC1)Cc1ccccc1.Cl
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.191g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.879g/mol
Monoisotopic Mass:
293.191g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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