2-chloro-N-{5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl}acetamide

https://huagongshe.com/de/chemical/2517813

Identifikatoren & physikalische Daten

CAS No.	450360-89-1
Summenformel	C13H13ClN2OS
Durchschnittliche Molmasse	280,77 g/mol
Monoisotopische Masse	280,0437119 g/mol
SMILES	Cc1cccc(Cc2cnc(NC(=O)CCl)s2)c1
InChIKey	KXFVWFYUQWFRKA-UHFFFAOYSA-N
PubChem CID	2517813
EC No.	828-137-9

Chemische & physikalische Eigenschaften

XLogP	3,4
Polarare Oberfläche (TPSA)	70,2
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	4
Schwere Atome	18
Formalladung	0
Komplexität	290

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): 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 (100%)

GHS-Einstufung

WarningH302 (100%): 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 (100%)