(2-((Dimethylamino)methyl)thiazol-4-yl)methanol

CBI-BB ZERO/005461 · Nizatidine Impurity 15 · Nizatidine EP impurity 1 · 2-(Dimethylaminomethyl)-4-thiazolemethano · 2-(Dimethylaminomethyl)-4-thiazolemethanol · 2-(Dimethylaminomethyl)thiazole-4-methanol · (2-DIMETHYLAMINOMETHYL-THIAZOL-4-YL)-METHANOL · 4-THIAZOLEMETHANOL, 2-[(DIMETHYLAMINO)METHYL]-

https://huagongshe.com/de/chemical/1838020

Molekülstruktur von (2-((Dimethylamino)methyl)thiazol-4-yl)methanol

Identifikatoren & physikalische Daten

CAS No.	78441-69-7
Summenformel	C7H12N2OS
Durchschnittliche Molmasse	172,25 g/mol
Monoisotopische Masse	172,06703418 g/mol
SMILES	CN(C)Cc1nc(CO)cs1
InChIKey	BIEFSXASVIQOOS-UHFFFAOYSA-N
PubChem CID	1838020
EC No.	809-745-3
DTXSID	DTXSID30365356

Chemische & physikalische Eigenschaften

XLogP	0
Polarare Oberfläche (TPSA)	64,6
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	3
Schwere Atome	11
Formalladung	0
Komplexität	121
Siedepunkt	273.1±25.0 °C(Predicted)
Dichte	1.208±0.06 g/cm3(Predicted)
Lagerbedingungen	2-8°C
pKa (Säurekonstante)	13.22±0.10(Predicted)
CAS Datenbank	78441-69-7(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	H411 (97.4%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P273, P391, 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.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard Classes and Categories	Aquatic Chronic 2 (97.4%)
R-Sätze (R)	51/53
Gefahrensymbole	N
Sicherheitshinweise (S)	61

Anwendungen & Verwendung

Verwenden

2-[(Dimethylamino)methyl]-4-thiazolemethanol is an impurity of the histamine H2-receptor antagonist Nizatidine (N598500).