D-プロリンtert-ブチル塩酸塩

tert-butyl (2R)-pyrrolidine-2-carboxylate hydrochloride

HCID 44629909CAS 184719-80-0

部分構造検索類似構造を探す

基本情報

標準SMILES: CC(C)(C)OC(=O)[C@H]1CCCN1.Cl
InChIKey: IUUYANMOEMBTBV-OGFXRTJISA-N
分子式: C9H18ClNO2
平均分子量: 207.7 g/mol
単同位体質量: 207.1026065

名称と識別子

優先名称: tert-butyl (2R)-pyrrolidine-2-carboxylate hydrochloride
IUPAC: tert-butyl (2R)-pyrrolidine-2-carboxylate;hydrochloride
現地名: D-プロリンtert-ブチル塩酸塩
英語名: D-PROLINE TERT-BUTYL ESTER HYDROCHLORIDE
分子式: C9H18ClNO2
分子量: 207.7

名称と別名

TERT-BUTYL (2R)-PYRROLIDINE-2-CARBOXYLATE HYDROCHLORIDERefChem:891652678-453-4184719-80-0(R)-tert-Butyl pyrrolidine-2-carboxylate hydrochlorideD-Proline tert-Butyl Ester HydrochlorideH-D-Pro-OtBu.HClMFCD00153460H-D-PRO-OTBU HCLh-d-pro-ptbu.hcltert-Butyl D-prolinate hydrochlorideD-proline t-butyl ester hydrochloride

名称をさらに表示

D-プロリンtert-ブチル塩酸塩D-プロリン tert-ブチル塩酸塩D-Pro-Obut.HCLH-D-Pro-OtBu. HCl ForMD-Proline tert-butyl ester HClD-Prolinetert-ButylEsterHydrochloride>D-PROLINE TERT-BUTYL ESTER HYDROCHLORIDE USP/EP/BPD-Prolinetert-butyl ester hydrochloride≥ 98% (HPLC)ert-butyl(2R)-pyrrolidine-2-carboxylate,hydrochloride

D-Proline, 1,1-dimethylethyl ester, hydrochlorideSCHEMBL596114tert-butyl (2R)-pyrrolidine-2-carboxylate;hydrochloride(R)-tert-Butyl pyrrolidine-2-carboxylate HClAKOS015847182(R)-tert-Butylpyrrolidine-2-carboxylatehydrochlorideH-D-Pro-otbu hydrochlorideEN300-175765

データベース識別子

CAS: 184719-80-0
PubChem CID: 44629909
DTXSID: DTXSID00659799
EC Number: 678-453-4

物性

構造計算による物性

極性表面積: 38.3 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 3
重原子数: 13
形式電荷: 0
複雑度: 172

物理化学的性質

融点: 94 °C · 94 °C
屈折率: 31 ° · 31 ° (C=1, H2O)
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2-8°C
水溶解度: Soluble in water
外見: powder to crystal
色: White to Almost white
CAS データベース: 184719 · 184719-80-0

化学的性質

化学的特性White to off-white powder

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.