カルバミン酸ベンジル(621-84-1)

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カルバミン酸ベンジル 製品概要
化学名:カルバミン酸ベンジル
英語化学名:Benzyl carbamate
别名:Z-AMIDE;BENZYLOXYCARBONYL AMIDE;BENZYL CARBAMATE;Benzylcarbamate (Z-NH2);Carbamic acid benzyl ester~Z-NH_2;Benzyl carbamate,98%;Phenylmethyl carbamate;Benzyl urethane
CAS番号:621-84-1
分子式:C8H9NO2
分子量:151.16
EINECS:210-710-4
カテゴリ情報:Building Blocks;Chemical Synthesis;Nitrogen Compounds;Organic Building Blocks;Protected Amines;Heterocycles;Nitrogen Compounds;Organic Building Blocks;Protected Amines;bc0001
Mol File:621-84-1.mol
カルバミン酸ベンジル
カルバミン酸ベンジル 物理性質
融点 86-89 °C (lit.)
沸点 273.17°C (rough estimate)
比重(密度) 1.2023 (rough estimate)
屈折率 1.5810 (estimate)
貯蔵温度 Keep in dark place,Sealed in dry,Room Temperature
溶解性Chloroform (Slightly), Methanol (Slightly)
酸解離定数(Pka)13.42±0.50(Predicted)
外見 Powder or Flakes
Off-white to light beige
水溶解度 68.02g/L(37 ºC)
BRN 1865635
InChIKeyPUJDIJCNWFYVJX-UHFFFAOYSA-N
CAS データベース621-84-1(CAS DataBase Reference)
NISTの化学物質情報Carbamic acid, benzyl ester(621-84-1)
安全性情報
主な危険性 Xn
Rフレーズ 20/21/22-36/37/38
Sフレーズ 22-24/25-36-26
WGK Germany 3
HSコード 29242995
MSDS Information
ProviderLanguage
Benzyl carbamate English
SigmaAldrich English
ACROS English
ALFA English
カルバミン酸ベンジル Usage And Synthesis
外観白色~うすい褐色、結晶~結晶性粉末
用途有機合成原料。
化学的特性Off-white to light beige powder or flakes, melting point 87-89 ℃. Insoluble in water, soluble in organic solvents such as benzene.
主な応用Benzyl carbamate is an intermediate in the synthesis of various pharmaceutical compounds. It can be also used as nondeuterated internal standards for the quantitative analysis of carisoprodol in blood.
使用Benzyl carbamate is a reagent used for the nucleophilic introduction of an amino-protected group, Benzyl carbamates can be considered as a benzyloxycarbonyl (otherwise known as carbobenzyloxy, Cbz or Z) protecting group for amino groups. It was introduced as a versatile alternative to the ethoxy carbamate group in peptide synthesis.
製造方法Benzyl carbamate is prepared by reacting benzyl chloroformate with ammonia. Benzyl chloroformate was slowly added to 5 times the volume of cold ammonia water (relative density 0.90) under vigorous stirring, the reaction mixture was placed at room temperature for 30 minutes, the precipitate was filtered out, washed with water and dried to obtain the finished product of benzyl carbamate.
純化方法If it smells of NH3, then dry it in a vacuum desiccator and recrystallise it from 2 volumes of toluene and dry it in a vacuum desiccator again. It forms glistening plates from toluene, and can be recrystallised from H2O [Martell & Herbst J Org Chem 6 878 1941, Carter et al. Org Synth Coll Vol III 168 1955]. [Beilstein 6 IV 2278.]
Tags:621-84-1