1,2-Ethanediamine, N'-(2-(4-methoxyphenyl)-4-quinolinyl)-N,N-dimethyl-

https://huagongshe.com/de/chemical/453054

Identifikatoren & physikalische Daten

CAS No.	133671-49-5
Summenformel	C20H23N3O
Durchschnittliche Molmasse	321,4 g/mol
Monoisotopische Masse	321,18411237 g/mol
SMILES	COc1ccc(-c2cc(NCCN(C)C)c3ccccc3n2)cc1
InChIKey	DPIXUMPQZPSUKL-UHFFFAOYSA-N
PubChem CID	453054
ChEMBL	CHEMBL46258
EC No.	665-274-1
DTXSID	DTXSID90158302

Chemische & physikalische Eigenschaften

XLogP	3,8
Polarare Oberfläche (TPSA)	37,4
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	6
Schwere Atome	24
Formalladung	0
Komplexität	368

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, 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 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	Acute Tox. 4 (100%)

GHS-Einstufung

WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, 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 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

Acute Tox. 4 (100%)