ethyl 4,6-dichloro-1H-indole-2-carboxylate

Ethyl4,6-dichloro-1H-indole · ETHYL,4,6-DICLOROINDOLE-2-CARBOXYLATE · ETHYL 4,6-DICHLOROINDOLE-2-CARBOXYLATE · Ethyl 4,6-dichloro-1H-indol-2-carboxylate · ETHYL 4,6-DICHLORO-1H-INDOLE-2-CARBOXYLATE · ethyl pyruvate-3,5-di-chlorophenylhydrazone · Ethyl 4,6-dichloro-1H-indole-2-carboxylate 97% · 4,6-DICHLOROINDOLE-2-CARBOXYLIC ACID ETHYL ESTER

https://huagongshe.com/de/chemical/2736407

Molekülstruktur von ethyl 4,6-dichloro-1H-indole-2-carboxylate

Identifikatoren & physikalische Daten

CAS No.	53995-82-7
Summenformel	C11H9Cl2NO2
Durchschnittliche Molmasse	258,1 g/mol
Monoisotopische Masse	257,00103389 g/mol
SMILES	CCOC(=O)c1cc2c(Cl)cc(Cl)cc2[nH]1
InChIKey	YLAHLUPONQVSOT-UHFFFAOYSA-N
PubChem CID	2736407
EC No.	675-926-7
DTXSID	DTXSID10371339

Chemische & physikalische Eigenschaften

XLogP	3,9
Polarare Oberfläche (TPSA)	42,1
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	3
Schwere Atome	16
Formalladung	0
Komplexität	275
Schmelzpunkt	171-172
Siedepunkt	405.0±40.0 °C(Predicted)
Dichte	1.432±0.06 g/cm3(Predicted)
Lagerbedingungen	2-8°C, protect from light
pKa (Säurekonstante)	13.21±0.30(Predicted)
CAS Datenbank	53995-82-7(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (50%)
Zollcode	2933998090
Gefahrensymbole	Xi
hazard_note	Irritant

Anwendungen & Verwendung

Verwenden

Ethyl 4,6-dichloro-1H-indole-2-carboxylate is used as a pharmaceutical intermediate in pharmaceutical synthesis and scientific research.