CAS 139592-92-0 | Piperidine, 1-[(4-fluorophenyl)methyl]- | CAS Number 139592-92-0

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139592-92-0 | Piperidine, 1-[(4-fluorophenyl)methyl]-

CAS No: 139592-92-0 Catalog No: AG001BCA MDL No:

Product Description

Catalog Number:

AG001BCA

Chemical Name:

Piperidine, 1-[(4-fluorophenyl)methyl]-

CAS Number:

139592-92-0

Molecular Formula:

C12H16FN

Molecular Weight:

193.2605

IUPAC Name:

1-[(4-fluorophenyl)methyl]piperidine

InChI:

InChI=1S/C12H16FN/c13-12-6-4-11(5-7-12)10-14-8-2-1-3-9-14/h4-7H,1-3,8-10H2

InChI Key:

NRXXCFFOTIFBGX-UHFFFAOYSA-N

SMILES:

Fc1ccc(cc1)CN1CCCCC1

Properties

Complexity:

158

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.265g/mol

Monoisotopic Mass:

193.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

3.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7

Literature

Title	Journal
Piperidine-based heterocyclic oxalyl amides as potent p38 alpha MAP kinase inhibitors.	Bioorganic & medicinal chemistry letters 20100201
Bis(triazacyclohexane) sandwich complexes of (Cu(I))(2), Cu(II) and Zn(II): complexes with cuprophilic attraction between two cationic copper(I) leading to unusual reactivity with dioxygen.	Dalton transactions (Cambridge, England : 2003) 20050821