Diethyl iminodiacetate (HCID 80502)

名称と識別子

優先名称: Diethyl iminodiacetate
IUPAC: ethyl 2-[(2-ethoxy-2-oxoethyl)amino]acetate
現地名: イミノ二酢酸ジエチル
英語名: Diethyl iminodiacetate
分子式: C8H15NO4
分子量: 189.21

名称と別名

Diethyl iminodiacetate6290-05-7Glycine, N-(2-ethoxy-2-oxoethyl)-, ethyl esterNSC 6950EINECS 228-533-6DTXSID0064200RefChem:133419DTXCID2043585N,NBis(ethoxycarbonylmethyl)amineEthyl N(2ethoxy2oxoethyl)glycinateAcetic acid, iminodi, diethyl esterGlycine, N(2ethoxy2oxoethyl), ethyl ester

名称をさらに表示

イミノ二酢酸ジエチルイミノ二(酢酸エチル)イミノジ酢酸ジエチルイミノジ(酢酸エチル)2,2'-イミノビス酢酸ジエチル2,2'-イミノビス(酢酸エチル)N-(2-エトキシ-2-オキソエチル)グリシンエチルイミノビス(酢酸エチル)ジエチル=2,2'-イミノジアセタートイミノジ酢酸ジエチルエステル2,2′-イミノビス(酢酸エチル)2,2′-イミノビス酢酸ジエチルジエチル=2,2′-イミノジアセタートエチル 2-[(2-エトキシ-2-オキソエチル)アミノ]アセタートN1-((ethylimino)methylene)-N3,N3-dimethylpropane-1,3-diamine hydrochloride)-, ethyLDiethylIminodiacetate>Diethyl iminodiacetate 98%Diethyl iminodiacetate,99%Diethyl iminodiacetic acidycine, N-(2-ethoxy-2-oxoethyLDiethyl iMinodiacetate, 99% 5GR

LJDNMOCAQVXVKY-UHFFFAOYSA-NDiethyl 2,2'-azanediyldiacetateIminodiacetic acid diethyl esterDIETHYLIMINODIACETATEethyl 2-[(2-ethoxy-2-oxoethyl)amino]acetateN,N-Bis(ethoxycarbonylmethyl)amineMFCD00041925Acetic acid, iminodi-, diethyl ester

データベース識別子

CAS: 6290-05-7
PubChem CID: 80502
DTXSID: DTXSID0064200
UNII: FQH4U4VY8P
EC Number: 228-533-6
Nikkaji: J35.497J

物性

構造計算による物性

XLogP: 0.4
極性表面積: 64.6 Å²
水素結合供与体数: 1
水素結合受容体数: 5
回転可能結合数: 8
重原子数: 13
形式電荷: 0
複雑度: 152

実験および物理化学的性質

Physical DescriptionLiquid; [Alfa Aesar MSDS]

物理化学的性質

沸点: 208 °C · 208 °C (lit.)
比重(密度): 1.056 g/mL · 1.056 g/mL at 25 °C (lit.)
屈折率: 20 · n20/D 1.435(lit.)
闪点: 230 °F · >230 °F
貯蔵温度: Keep in dark place,Sealed in dry,Room Temperature
酸解離定数(Pka): 4.92 · 4.92±0.20(Predicted)
外見: 粘性液体
色: クリアライトイエロー～イエロー
水溶解度: 水に中程度に溶ける。
InChI: InChI=1S/C8H15NO4/c1-3-12-7(10)5-9-6-8(11)13-4-2/h9H,3-6H2,1-2H3
InChIKey: LJDNMOCAQVXVKY-UHFFFAOYSA-N
SMILES: C(OCC)(=O)CNCC(OCC)=O
CAS データベース: 6290 · 6290-05-7(CAS DataBase Reference)
EPAの化学物質情報: Glycine, N-(2-ethoxy-2-oxoethyl)-, ethyl ester (6290-05-7)

化学的性質

化学的特性clear colorless to slightly yellow liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 44 reports by companies from 6 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

Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS]

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (97.7%)；STOT SE 3 (97.7%)

安全データ

wgk: 3
tsca: TSCA listed
ridadr: 1993
hs_code: 29252900
risk_code: 36/37/38
化審法: (2)-3117
消防法: 危-4-3-III
hazard_code: Xi
safety_code: 26-36-37/39
hazard_class: 3.2
packing_group: III
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 10 - Combustible liquids

化学と産業

用途と製造

General Manufacturing InformationGlycine, N-(2-ethoxy-2-oxoethyl)-, ethyl ester: ACTIVE

応用分野

使用It is mainly used for the manufacture of N-(Phosphonomethyl) iminodiacetic acid and glyphosate. Used as raw material for ion exchange resin; for rubbers, electroplating and food additives.