1-ニトロ-3-メチルブタン

1-ニトロ-3-メチルブタン 化学構造式
627-67-8
CAS番号.
627-67-8
化学名:
1-ニトロ-3-メチルブタン
别名:
4-ニトロ-2-メチルブタン;3-メチル-1-ニトロブタン;1-ニトロ-3-メチルブタン
英語名:
3-methyl-1-nitrobutane
英語别名:
1-Nitro-3-methylbutane;4-Nitro-2-methylbutane;3-methyl-1-nitrobutane;Butane, 3-methyl-1-nitro-
CBNumber:
CB1890187
化学式:
C5H11NO2
分子量:
117.15
MOL File:
627-67-8.mol

1-ニトロ-3-メチルブタン 物理性質

融点 :
97°C
沸点 :
168.95°C (estimate)
比重(密度) :
0.9458
屈折率 :
1.4153
酸解離定数(Pka):
8.65±0.29(Predicted)
LogP:
1.800 (est)

安全性情報

1-ニトロ-3-メチルブタン 価格

メーカー 製品番号 製品説明 CAS番号 包装 価格 更新時間 購入

1-ニトロ-3-メチルブタン 化学特性,用途語,生産方法

製造方法

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)
説明図
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

定義

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.

1-ニトロ-3-メチルブタン 上流と下流の製品情報

原材料

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1-ニトロ-3-メチルブタン 生産企業

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  • 627-67-8
  • 3-methyl-1-nitrobutane
  • 4-Nitro-2-methylbutane
  • Butane, 3-methyl-1-nitro-
  • 1-Nitro-3-methylbutane
  • 4-ニトロ-2-メチルブタン
  • 3-メチル-1-ニトロブタン
  • 1-ニトロ-3-メチルブタン
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