Ethyl-4-hydroxypiperidin-1-carboxylat

ETHYL 4-HYDROXY-1-PIPERIDINECARBOXYLATE · N-CARBETHOXY-4-PIPERIDINOL · 1-CARBETHOXY-4-HYDROXYPIPERIDINE · N-Carbethoxy-4-piperidino · 1-CARBETHOXY-4-PIPERIDINOL · N-Carboethoxypiperidine-4-Ol · Ethyl 4-Hydroxy-1-piperidine · Ethyl 4-hydroxypiperidine-1-

https://huagongshe.com/de/chemical/96394

Molekülstruktur von Ethyl-4-hydroxypiperidin-1-carboxylat

Identifikatoren & physikalische Daten

CAS No.	65214-82-6
Summenformel	C8H15NO3
Durchschnittliche Molmasse	173,21 g/mol
Monoisotopische Masse	173,10519334 g/mol
SMILES	CCOC(=O)N1CCC(O)CC1
InChIKey	QABJNOSERNVHDY-UHFFFAOYSA-N
PubChem CID	96394
EC No.	265-636-5
DTXSID	DTXSID50215521
Lokaler Name	Ethyl-4-hydroxypiperidin-1-carboxylat

Chemische & physikalische Eigenschaften

XLogP	0,4
Polarare Oberfläche (TPSA)	49,8
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	2
Schwere Atome	12
Formalladung	0
Komplexität	152
Siedepunkt	120-130 °C(Press: 0.098 Torr)
Dichte	1.12
Brechungsindex	1.4802
Lagerbedingungen	Inert atmosphere,Room Temperature
Aggregatzustand	clear liquid
pKa (Säurekonstante)	14.80±0.20(Predicted)
Farbe	Colorless to Light yellow to Light orange
InChI	InChI=1S/C8H15NO3/c1-2-12-8(11)9-5-3-7(10)4-6-9/h7,10H,2-6H2,1H3
InChIKey	QABJNOSERNVHDY-UHFFFAOYSA-N
SMILES	N1(C(OCC)=O)CCC(O)CC1
CAS Datenbank	65214-82-6(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.WarningH315 (33.3%): 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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische Informationen	Status: Active Update: 09-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32629
Hazard Classes and Categories	Skin Irrit. 2 (33.3%)
Zollcode	29333990
Sicherheitshinweise (S)	24/25

Anwendungen & Verwendung

Verwenden

Ethyl 4-hydroxypethidine-1-carboxylate is mainly used as a pharmaceutical intermediate and a raw material for organic matter. It can be used in the synthesis of antihistamines, antipsychotics, antidepressants, and various pesticides. As an intermediate, the compound can also produce fungicides and insecticides. It can be used as a raw material for synthetic surfactants, flavors, and fragrances.