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89768-39-8 | Piperidine, 2-[(4-cyclohexylphenyl)methyl]-, hydrochloride
CAS No: 89768-39-8 Catalog No: AG00402K MDL No:
Product Description
Catalog Number:
AG00402K
Chemical Name:
Piperidine, 2-[(4-cyclohexylphenyl)methyl]-, hydrochloride
CAS Number:
89768-39-8
Molecular Formula:
C18H28ClN
Molecular Weight:
293.8746
IUPAC Name:
2-[(4-cyclohexylphenyl)methyl]piperidine;hydrochloride
InChI:
InChI=1S/C18H27N.ClH/c1-2-6-16(7-3-1)17-11-9-15(10-12-17)14-18-8-4-5-13-19-18;/h9-12,16,18-19H,1-8,13-14H2;1H
InChI Key:
JUZHAESNPBUZFD-UHFFFAOYSA-N
SMILES:
C1CCC(NC1)Cc1ccc(cc1)C1CCCCC1.Cl
Properties
Complexity:
248
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:
2
Isotope Atom Count:
0
Molecular Weight:
293.879g/mol
Monoisotopic Mass:
293.191g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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