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164650-63-9 | Piperidine, 4-(phenylmethylene)-, hydrochloride (1:1)
CAS No: 164650-63-9 Catalog No: AG001V0F MDL No:
Product Description
Catalog Number:
AG001V0F
Chemical Name:
Piperidine, 4-(phenylmethylene)-, hydrochloride (1:1)
CAS Number:
164650-63-9
Molecular Formula:
C12H16ClN
Molecular Weight:
209.7151
IUPAC Name:
4-benzylidenepiperidine;hydrochloride
InChI:
InChI=1S/C12H15N.ClH/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12;/h1-5,10,13H,6-9H2;1H
InChI Key:
GKHTYRZQRHFMIL-UHFFFAOYSA-N
SMILES:
N1CCC(=Cc2ccccc2)CC1.Cl
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.097g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.717g/mol
Monoisotopic Mass:
209.097g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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