CAS 23007-85-4 | Pyridine, 1,2,3,6-tetrahydro-1-methyl-4-phenyl-, hydrochloride (1:1) | CAS Number 23007-85-4

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23007-85-4 | Pyridine, 1,2,3,6-tetrahydro-1-methyl-4-phenyl-, hydrochloride (1:1)

CAS No: 23007-85-4 Catalog No: AG002LU6 MDL No:MFCD00012790

Product Description

Catalog Number:

AG002LU6

Chemical Name:

Pyridine, 1,2,3,6-tetrahydro-1-methyl-4-phenyl-, hydrochloride (1:1)

CAS Number:

23007-85-4

Molecular Formula:

C12H16ClN

Molecular Weight:

209.7151

MDL Number:

MFCD00012790

IUPAC Name:

1-methyl-4-phenyl-3,6-dihydro-2H-pyridine;hydrochloride

InChI:

InChI=1S/C12H15N.ClH/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11;/h2-7H,8-10H2,1H3;1H

InChI Key:

KOWJANGMTAZWDT-UHFFFAOYSA-N

SMILES:

CN1CCC(=CC1)c1ccccc1.Cl

UNII:

5O1K9K2EZM

Properties

Complexity:

189

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.097g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.717g/mol

Monoisotopic Mass:

209.097g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

3.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Interactions of 1-methyl-3-phenylpyrrolidine and 3-methyl-1-phenyl-3-azabicyclo[3.1.0]hexane with monoamine oxidase B.	Bioorganic & medicinal chemistry 20100601
Vesicular monoamine transporter substrate/inhibitor activity of MPTP/MPP+ derivatives: a structure-activity study.	Journal of medicinal chemistry 20080227
Structure-affinity relationships of a unique nicotinic ligand: N(1)-dimethyl-N(4)-phenylpiperazinium iodide (DMPP).	Journal of medicinal chemistry 20011108
Approaches to protection against nerve agent poisoning. (Naphthylvinyl)pyridine derivatives as potential antidotes.	Journal of medicinal chemistry 19880401