5-[(3-Fluorophenyl)methyl]-1,3-thiazol-2-amine

AKOS BBV-005115 · CHEMBRDG-BB 4003562 · 5-(3-Fluorobenzyl)thiazol-2-amine · 5-(3-FLUORO-BENZYL)-THIAZOL-2-YLAMINE · 5-(3-Fluorobenzyl)-1,3-thiazol-2-amine · 2-Thiazolamine, 5-[(3-fluorophenyl)methyl]- · 5-[(3-FLUOROPHENYL)METHYL]-1,3-THIAZOL-2-AMINE · 5-(3-fluorobenzyl)-1,3-thiazol-2-amine(SALTDATA: FREE)

https://huagongshe.com/de/chemical/3387134

Molekülstruktur von 5-[(3-Fluorophenyl)methyl]-1,3-thiazol-2-amine

Identifikatoren & physikalische Daten

CAS No.	884497-40-9
Summenformel	C10H9FN2S
Durchschnittliche Molmasse	208,26 g/mol
Monoisotopische Masse	208,04704763 g/mol
SMILES	Nc1ncc(Cc2cccc(F)c2)s1
InChIKey	TZTVOZBUYKWEMJ-UHFFFAOYSA-N
PubChem CID	3387134
EC No.	870-029-9
DTXSID	DTXSID00392018

Chemische & physikalische Eigenschaften

XLogP	2,7
Polarare Oberfläche (TPSA)	67,2
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	2
Schwere Atome	14
Formalladung	0
Komplexität	191
Aggregatzustand	solid
InChI	1S/C10H9FN2S/c11-8-3-1-2-7(4-8)5-9-6-13-10(12)14-9/h1-4,6H,5H2,(H2,12,13)
InChIKey	TZTVOZBUYKWEMJ-UHFFFAOYSA-N
SMILES	NC1=NC=C(CC2=CC(F)=CC=C2)S1

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, P317, 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 3 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%)
Wassergefährdungsklasse (WGK)	WGK 3
R-Sätze (R)	22
Gefahrensymbole	Xn
Gefahrenklasse	IRRITANTAcute Tox. 4 Oral
Lagerklasse	11 - Combustible Solids