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Merck
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Documenti fondamentali

M72609

Sigma-Aldrich

N-Methylpiperidine

99%

Sinonimo/i:

1-Methylpiperidine

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About This Item

Formula empirica (notazione di Hill):
C6H13N
Numero CAS:
Peso molecolare:
99.17
Beilstein:
1073
Numero CE:
Numero MDL:
Codice UNSPSC:
12352100
ID PubChem:
NACRES:
NA.22

Saggio

99%

Indice di rifrazione

n20/D 1.4378 (lit.)

P. ebollizione

106-107 °C (lit.)

Densità

0.816 g/mL at 25 °C (lit.)

Stringa SMILE

CN1CCCCC1

InChI

1S/C6H13N/c1-7-5-3-2-4-6-7/h2-6H2,1H3
PAMIQIKDUOTOBW-UHFFFAOYSA-N

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Applicazioni

Reactant for:
  • sp3 C-H Bond activation with ruthenium(II) catalysts and C(3)-alkylation of cyclic amines
  • One-pot synthesis of Z-cinnamic acids

Reactant for synthesis of:
  • Unsymmetrical ureas
  • Antibacterial imidazolium, pyrrolidinium, and piperidinium salts
  • C1-C16 segment of goniodomin A via palladium-catalyzed organostannane thioester coupling
  • Multi-targeted inhibitors of insulin-like growth factor-1 receptor and members of ErbB-family receptor kinases

Avvertenze

Danger

Indicazioni di pericolo

Classi di pericolo

Acute Tox. 3 Inhalation - Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Aquatic Chronic 3 - Eye Dam. 1 - Flam. Liq. 2 - Skin Corr. 1B

Codice della classe di stoccaggio

3 - Flammable liquids

Classe di pericolosità dell'acqua (WGK)

WGK 2

Punto d’infiammabilità (°F)

37.4 °F - closed cup

Punto d’infiammabilità (°C)

3 °C - closed cup

Dispositivi di protezione individuale

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter


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Certificati d'analisi (COA)

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Magnetic resonance in chemistry : MRC, 45(3), 231-235 (2007-01-16)
The (15)N chemical shifts of 13 N-methylpiperidine-derived mono-, bi- and tricycloaliphatic tertiary amines, their methiodides and their N-epimeric pairs of N-oxides were measured, and the contributions of specific structural parameters to the chemical shifts were determined by multilinear regression analysis.
A Kolocouris et al.
The Journal of organic chemistry, 66(15), 4989-4997 (2001-07-21)
When a 1-adamantyl or a 2-adamantyl substituent is introduced at the 2-position in N-methylpiperidine, four different chair conformations are possible. Experimental observation using dynamic NMR spectroscopy and molecular mechanics calculations agree that the chair conformation with an equatorial adamantyl group

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