グリシンプロピル・塩酸塩

Propyl aminoacetate hydrochloride

HCID 2759254

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 13049-01-9
標準SMILES: CCCOC(=O)CN.Cl
InChIKey: YDBMNSABUROTEK-UHFFFAOYSA-N
分子式: C5H12ClNO2
平均分子量: 153.61 g/mol
単同位体質量: 153.0556563

名称と識別子

優先名称: Propyl aminoacetate hydrochloride
IUPAC: propyl 2-aminoacetate;hydrochloride
現地名: グリシンプロピル・塩酸塩
英語名: Glycine n-propyl ester hydrochloride
分子式: C5H12ClNO2
分子量: 153.61

名称と別名

RefChem:869727235-925-0EINECS 235-925-0Propyl aminoacetate HClPropyl aminoacetate hydrochloride13049-01-9GLYCINE N-PROPYL ESTER HYDROCHLORIDEPropyl 2-aminoacetate HydrochlorideGLYCINE N-PROPYL ESTER HCLpropyl 2-aminoacetate;hydrochlorideGlycine, propyl ester, hydrochloride (1:1)MFCD00151829

名称をさらに表示

グリシンプロピル・塩酸塩GlycinepropylesterHClGlycinen-propylesterHClPROPYL GLYCINATE HYDROCHLORIDE(2-oxo-2-propoxyethyl)ammonium chlorideGLYCINE N-PROPYL ESTER HYDROCHLORIDE USP/EP/BP

glycine propyl ester hydrochlorideSCHEMBL723032Propyl2-aminoacetateHydrochlorideDTXSID90926760AKOS022180765AS-40656DB-041963Propyl glycinate--hydrogen chloride (1/1)

データベース識別子

CAS: 13049-01-9
PubChem CID: 2759254
DTXSID: DTXSID90926760
EC Number: 235-925-0

物性

構造計算による物性

極性表面積: 52.3 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: 4
重原子数: 9
形式電荷: 0
複雑度: 72

物理化学的性質

融点: 78 · 78-80°C
貯蔵温度: Sealed in dry,Room Temperature
外見: solid
InChI: 1S/C5H11NO2.ClH/c1-2-3-8-5(7)4-6;/h2-4,6H2,1H3;1H
InChIKey: YDBMNSABUROTEK-UHFFFAOYSA-N
CAS データベース: 13049 · 13049-01-9

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (83.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (16.7%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (83.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (83.3%)；Skin Sens. 1 (16.7%)；Eye Irrit. 2 (100%)；STOT SE 3 (83.3%)

安全データ

wgk: WGK 3
safety_code: 22-24/25
Hazard Classifications: Eye Irrit. 2Skin Sens. 1
ストレージクラス: 11 - Combustible Solids

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