49827-48-7

• 常用中文名：2-Pentyl-2-methylheptanonitrile
• 常用英文名：2-Pentyl-2-methylheptanonitrile
• CAS号：49827-48-7
• 分子式：C₁₃H₂₅N
• 分子量：195.34400
• 发布时间：2016-08-30 02:04:45
• 更新时间：2025-08-26 17:18:24

名称

• 英文名: 2-methyl-2-pentylheptanenitrile
• 英文别名: 6-cyano-6-methylundecane; 2-Pentyl-2-methylheptanonitrile; 1-HEPTANENITRILE,2-METHYL-2-PENTYL; Propionitrile,2-dipentyl; Propionitrile,2,2-dipentyl; Undecane,6-cyano-6-methyl; Heptanenitrile,2-methyl-2-pentyl

物化性质

• 密度: 0.825g/cm3
• 沸点: 273.3ºC at 760 mmHg
• 分子式: C₁₃H₂₅N
• 分子量: 195.34400
• 闪点: 103.4ºC
• 精确质量: 195.19900
• PSA: 23.79000
• LogP: 4.67688
• 折射率: 1.438

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : MJ1300000 CHEMICAL NAME : 1-Heptanenitrile, 2-methyl-2-pentyl- CAS REGISTRY NUMBER : 49827-48-7 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C13-H25-N HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 180 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01342

合成路线

110-53-2 107-12-0 ~61% 49827-48-7

文献：Lortie, Frederic; Boileau, Sylvie; Bouteiller, Laurent Chemistry - A European Journal, 2003 , vol. 9, # 13 p. 3008 - 3014

110-53-2 54321-41-4 ~% 49827-48-7

文献：Rojas, Giovanni; Baughman, Travis W.; Wagener, Kenneth B. Synthetic Communications, 2007 , vol. 37, # 22 p. 3923 - 3931

110-53-2 ~% 49827-48-7

文献：Kamata,S. et al. Synthetic Communications, 1973 , vol. 3, p. 265 - 272

49827-13-6 ~% 49827-48-7

文献：Kamata,S. et al. Synthetic Communications, 1973 , vol. 3, p. 265 - 272

49827-22-7 74-88-4 ~% 49827-48-7

文献：Kamata,S. et al. Synthetic Communications, 1973 , vol. 3, p. 265 - 272

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