1-Piperidinecarboxylic acid, ethyl ester

NSC 236 · NSC 100911 · N-Carbethoxypiperidine · pentamethyleneurethane · 1-Ethoxycarbonylpiperidine · N-(Ethoxycarbonyl)piperidine · Ethyl 1-piperidinecarboxylate · 1-piperidinecarboxylicacid,ethylester

https://huagongshe.com/de/chemical/21399

Molekülstruktur von 1-Piperidinecarboxylic acid, ethyl ester

Identifikatoren & physikalische Daten

CAS No.	5325-94-0
Summenformel	C8H15NO2
Durchschnittliche Molmasse	157,21 g/mol
Monoisotopische Masse	157,11027872 g/mol
SMILES	CCOC(=O)N1CCCCC1
InChIKey	YSPVHAUJXLGZHP-UHFFFAOYSA-N
PubChem CID	21399
EC No.	625-971-3
DTXSID	DTXSID90201362

Chemische & physikalische Eigenschaften

XLogP	1,3
Polarare Oberfläche (TPSA)	29,5
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	2
Schwere Atome	11
Formalladung	0
Komplexität	130
Siedepunkt	183 °C(lit.)
Dichte	1.018 g/mL at 25 °C(lit.)
Brechungsindex	n20/D 1.459(lit.)
Flammpunkt	187 °F
Lagerbedingungen	Sealed in dry,Room Temperature
pKa (Säurekonstante)	-1.28±0.20(Predicted)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH315 (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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Wassergefährdungsklasse (WGK)	3
Zollcode	2933399990
RTECS-Nr.	TM6300000
R-Sätze (R)	36/37/38
Gefahrensymbole	Xi
Sicherheitshinweise (S)	26-36

Anwendungen & Verwendung

Verwenden

N-acylpiperidine derivative,(Ethyl 1-piperidinecarboxylate) can be used in structure correlation studies with respect to mosquito repellent activity.