39945-54-5

• 常用中文名：3-溴丙基氨基甲酸苄酯
• 常用英文名：Benzyl (3-bromopropyl)carbamate
• CAS号：39945-54-5
• 分子式：C₁₁H₁₄BrNO₂
• 分子量：272.138
• 发布时间：2018-03-06 08:00:00
• 更新时间：2024-01-16 12:56:02

名称

• 中文名: 3-溴丙基氨基甲酸苄酯
• 英文名: tert-butyl n-(3-bromopropyl)carbamate
• 英文别名: N-(TERT-BUTOXYCARBONYL)-3-BROMOPROPYLAMINE; 3-(N-benzyloxycarbonyl)amino-1-bromopropane; Wln: E3mvo1r; (3-bromopropyl)-carbamicacibenzylester; N-(3-bromopropyl)-carbamic acid phenylmethyl ester; Br(CH2)3NHCbz; Benzyl N-(3-broMopropyl)carbaMate; Carbamic acid, N-(3-bromopropyl)-, phenylmethyl ester; Benzyl (3-bromopropyl)carbamate; N-(3-bromopropyl)carbamic acid benzyl ester; Carbamic acid,(2-bromopropyl)-,benzyl ester; (3-bromopropyl)carbamicacidbenzylester; N-Cbz-3-bromopropylamine; Phenylmethyl N-(3-Bromopropyl)Carbamate; N-BOC-3-BROMOPROPYLAMINE; Carbamic acid, (3-bromopropyl)-, phenylmethyl ester (9CI); N-Benzyloxycarbonyl-3-bromopropylamine; CbzNH(CH2)3Br

物化性质

• 密度: 1.4±0.1 g/cm3
• 沸点: 379.4±35.0 °C at 760 mmHg
• 熔点: 37-39ºC
• 分子式: C₁₁H₁₄BrNO₂
• 分子量: 272.138
• 闪点: 183.3±25.9 °C
• 精确质量: 271.020782
• PSA: 38.33000
• LogP: 3.02
• 蒸汽压: 0.0±0.9 mmHg at 25°C
• 折射率: 1.550
• 储存条件: -20°C，干燥密封

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : EY9765000 CHEMICAL NAME : Carbamic acid, (3-bromopropyl)-, benzyl ester CAS REGISTRY NUMBER : 39945-54-5 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C11-H14-Br-N-O2 MOLECULAR WEIGHT : 272.17 WISWESSER LINE NOTATION : E3MVO1R 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 : 56 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#02337

安全

• 危害码 (欧洲): Xn

合成路线

5003-71-4 501-53-1 ~99% 39945-54-5

文献：LIGHTSHIP MEDICAL LIMITED; JAMES, Tony; BARWELL, Nicholas, Paul Patent: WO2012/95628 A1, 2012 ; Location in patent: Page/Page column 20 ;

13139-17-8 5003-71-4 ~94% 39945-54-5

文献：STARPHARMA PTY LIMITED Patent: WO2007/82331 A1, 2007 ; Location in patent: Page/Page column 100-101 ;

34637-22-4 ~93% 39945-54-5

文献：Dai, Chunhui; Narayanam, Jagan M.R.; Stephenson, Corey R.J. Nature Chemistry, 2011 , vol. 3, # 2 p. 140 - 145

5003-71-4 1885-14-9 ~78% 39945-54-5

文献：Meng; Qingchang; Slassi; Abdelmalik; Rakhit; Sumanas Patent: US5654431 A1, 1997 ; US 5654431 A

18370-81-5 501-53-1 ~76% 39945-54-5

文献：Khan, Hassan A.; Robins, David J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1985 , p. 101 - 106

174626-34-7 ~% 39945-54-5

文献：Carrasco, Michael R.; Alvarado, Carolina I.; Dashner, Scott T.; Wong, Amanda J.; Wong, Michael A. Journal of Organic Chemistry, 2010 , vol. 75, # 16 p. 5757 - 5759

上下游产品

上游产品  7
5003-71-4 501-53-1 13139-17-8 34637-22-4
1885-14-9 18370-81-5 174626-34-7
下游产品  6
100841-04-1 16644-57-8 92-52-4 302569-84-2
65095-17-2 71-43-2