Nanofin - CAS 504-03-0
Catalog number: 504-03-0
Category: Inhibitor
Not Intended for Therapeutic Use. For research use only.
Molecular Formula:
C7H15N
Molecular Weight:
113.2
COA:
Inquire
Targets:
Others
Description:
Nanofin is neuropathic blocker used for mild to moderate hypertension.
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Purity:
≥95%
Appearance:
Clear colorless to slightly yellow liquid
Synonyms:
2,6-dimethylpiperidine;
Solubility:
Soluble in DMSO
Storage:
Store at -20 °C
MSDS:
Inquire
Application:
Neuropathic blocker,
Quality Standard:
Enterprise Standard/USP
Shelf Life:
As supplied, 2 years from the QC date provided on the Certificate of Analysis, when stored properly
Quantity:
Grams-Kilos
Boiling Point:
127 °C
Melting Point:
14 °C
Density:
0.84
InChIKey:
SDGKUVSVPIIUCF-UHFFFAOYSA-N
InChI:
1S/C7H15N/c1-6-4-3-5-7(2)8-6/h6-8H,3-5H2,1-2H3
Canonical SMILES:
CC1CCCC(N1)C
1.Mechanism of hydrodenitrogenation on phosphides and sulfides.
Oyama ST1, Lee YK. J Phys Chem B. 2005 Feb 17;109(6):2109-19.
The mechanism of hydrodenitrogenation (HDN) of 2-methylpiperidine was studied over a silica-supported nickel phosphide catalyst (Ni2P/SiO2, Ni/P = 1/2) and a commercial Ni-Mo-S/Al2O3 catalyst in a three-phase trickle-bed reactor operated at 3.1 MPa and 450-600 K. Analysis of the product distribution as a function of contact time indicated that the reaction proceeded in both cases predominantly by a substitution mechanism, with a smaller contribution of an elimination mechanism. Fourier transform infrared spectroscopy (FTIR) of the 2-methylpiperidine indicated that at reaction conditions a piperidinium ion intermediate was formed on both the sulfide and the phosphide. It is concluded that the mechanism of HDN on nickel phosphide is very similar to that on sulfides. The mechanism on the nickel phosphide was also probed by comparing the reactivity of piperidine and several of its derivatives in the presence of 3000 ppm S. The relative elimination rates depended on the structure of the molecules, and followed the sequence: 4-methylpiperidine approximately piperidine > 3-methylpiperidine > 2,6-dimethylpiperidine > 2-methylpiperidine.
2.Combined experimental and computational study of the thermochemistry of methylpiperidines.
Ribeiro da Silva MA1, Cabral JI, Gomes P, Gomes JR. J Org Chem. 2006 May 12;71(10):3677-85.
To understand the influence of the methyl group in the stability and conformational behavior of the piperidine ring, the standard (p0= 0.1 MPa) molar enthalpies of formation of 1-methylpiperidine, 3-methylpiperidine, 4-methylpiperidine, 2,6-dimethylpiperidine, and 3,5-dimethylpiperidine, both in the liquid and in the gaseous states, were determined at the temperature of 298.15 K. The numerical values of the enthalpies of formation in the liquid and in the gaseous state are, respectively, -(95.9 +/- 1.6) and -(59.1 +/- 1.7) kJ.mol(-1) for 1-methylpiperidine; -(123.6 +/- 1.4) and -(79.2 +/- 1.6) kJ.mol(-1) for 3-methylpiperidine; -(123.5 +/- 1.5) and -(82.9 +/- 1.7) kJ.mol(-1) for 4-methylpiperidine; -(153.6 +/- 2.1) and -(111.2 +/- 2.2) kJ.mol(-1) for 2,6-dimethylpiperidine; and -(155.0 +/- 1.7) and -(105.9 +/- 1.8) kJ.mol(-1) for 3,5-dimethylpiperidine. In addition, and to be compared with the experimental results, theoretical calculations were carried out considering different ab initio and density functional theory based methods.
3.The ligand-based quintuple bond-shortening concept and some of its limitations.
Noor A1, Bauer T, Todorova TK, Weber B, Gagliardi L, Kempe R. Chemistry. 2013 Jul 22;19(30):9825-32. doi: 10.1002/chem.201301240. Epub 2013 Jul 2.
Herein, the ligand-based concept of shortening quintuple bonds and some of its limitations are reported. In dichromium-diguanidinato complexes, the length of the quintuple bond can be influenced by the substituent at the central carbon atom of the used ligand. The guanidinato ligand with a 2,6-dimethylpiperidine backbone was found to be the optimal ligand. The reduction of its chromium(II) chloride-ate complex gave a quintuply bonded bimetallic complex with a Cr-Cr distance of 1.7056 (12) Å. Its metal-metal distance, the shortest observed in any stable compound yet, is of essentially the same length as that of the longest alkane C-C bond (1.704 (4) Å). Both molecules, the alkane and the Cr complex, are of remarkable stability. Furthermore, an unsupported Cr(I) dimer with an effective bond order (EBO) of 1.25 between the two metal atoms, indicated by CASSCF/CASPT2 calculations, was isolated as a by-product. The formation of this by-product indicates that with a certain bulk of the guanidinato ligand, other coordination isomers become relevant.
4.Derivatives of 2-mercaptobenzenesulphonamide. VIII. Synthesis and some pharmacological properties of 1,3-dialkyl-2-(4-chloro-2-carboxyalkylthio-5-methylbenzenesulphonyl) guanidines.
Brzozowski Z1, Sławiński J, Filczewski M, Szymańska-Kosmala M, Miłobedzka J, Oledzka K. Acta Pol Pharm. 1990;47(1-2):57-63.
Synthesis of 1,3-dialkyl-2-(4-chloro-2-carboxyalkylthio-5-methylbenzenesulphonyl)guanidines (IX-XVII) and their easily soluble in water sodium (Xa-XIVa, XVIIa) or 2,6-dimethylpiperidine salts (XIb, XVIIb) have been described. The results of preliminary pharmacological examinations such as acute toxicity and influence on circulatory system have been presented.
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CAS 504-03-0 Nanofin

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