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3-Methyl-1-nitrobutan

3-methyl-1-nitrobutane  Struktur
627-67-8
CAS-Nr.
627-67-8
Bezeichnung:
3-Methyl-1-nitrobutan
Englisch Name:
3-methyl-1-nitrobutane
Synonyma:
1-Nitro-3-methylbutane;4-Nitro-2-methylbutane;3-methyl-1-nitrobutane;Butane, 3-methyl-1-nitro-
CBNumber:
CB1890187
Summenformel:
C5H11NO2
Molgewicht:
117.15
MOL-Datei:
627-67-8.mol

3-Methyl-1-nitrobutan Eigenschaften

Schmelzpunkt:
97°C
Siedepunkt:
168.95°C (estimate)
Dichte
0.9458
Brechungsindex
1.4153
pka
8.65±0.29(Predicted)
LogP
1.800 (est)

Sicherheit

3-Methyl-1-nitrobutan Chemische Eigenschaften,Einsatz,Produktion Methoden

synthetische

Synthesis of 3-methyl-1-nitrobutane: Isopentyl bromide (120.84 g, 0.80 mol) was added dropwise to a mechanical stirred solution of sodium nitrite (110.39g, 1.60 mol) in DMF (500 mL) at 0°C. The reaction mixture was mechanically stirred overnight at room temperature. Water (1 L) was added to the mixture. The mixture was extracted with pet. ether (4 x 150 mL). The combined organic phases were washed with water (2 x 150 mL). The organic phase was dried with Na2SO4 then the solvent was evaporated under reduced pressure. Distillation under vacuum gave 30.2g (32%) of the colorless nitroalkane 3-methyl-1-nitrobutane (b.p. 58 - 60°C 21 mmHg)
Synthesis of 3-methyl-1-nitrobutane
Not visible on TLC IR (neat) ν 2962, 1549, 1470, 1434, 1434, 1381, 1211, 1133, 851 cm-1 . 1H NMR (500 MHz, CDCl3) a 0.96 (d, J = 6.7 Hz, 6 H), 1.69 (h, J = 6.7Hz, 1 H), 1.91 (q, J = 7.2 Hz, 2 H), 4.41 (t, J = 7.3 Hz, 2 H). 13C NMR (125 MHz, CDCl3) a = 21.9, 25.5, 35.9, 74.2

Definition

ChEBI: 3-methyl-1-nitrobutane is a primary nitroalkane that is 2-methylbutane substituted by a nitro group at position 4. It is a herbivore-induced plant volatile found in the leaves of Oenothera biennis. It has a role as a plant metabolite. It is a primary nitroalkane and a volatile organic compound.

3-Methyl-1-nitrobutan Upstream-Materialien And Downstream Produkte

Upstream-Materialien

Downstream Produkte


3-Methyl-1-nitrobutan Anbieter Lieferant Produzent Hersteller Vertrieb H?ndler.

Global( 17)Lieferanten
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Accela ChemBio Inc.
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Block Chemical Technology (Shanghai) Co., LTD 021-20432219 13918097649
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  • 3-methyl-1-nitrobutane
  • 4-Nitro-2-methylbutane
  • Butane, 3-methyl-1-nitro-
  • 1-Nitro-3-methylbutane
  • 627-67-8
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