6-Chlor-9-(tetrahydro-2H-pyran-2-yl)-9H-purin

6-Chloro-9-(tetrahydro-2H-pyran-2-yl)-9H-purine · 6-Chloro-9-(oxan-2-yl)purine · 6-chloro-9-(oxan-2-yl)-9H-purine · EOS-60722 · Einecs 230-757-4 · 6-Chloropurine-THP · TIMTEC-BB SBB005344 · 6-CHLORO-9-(TETRAHYD

https://huagongshe.com/de/chemical/97740

Molekülstruktur von 6-Chlor-9-(tetrahydro-2H-pyran-2-yl)-9H-purin

Identifikatoren & physikalische Daten

CAS No.	7306-68-5
Summenformel	C10H11ClN4O
Durchschnittliche Molmasse	238,67 g/mol
Monoisotopische Masse	238,06213865 g/mol
SMILES	Clc1ncnc2c1ncn2C1CCCCO1
InChIKey	QSTASPNCKDPSAH-UHFFFAOYSA-N
PubChem CID	97740
EC No.	230-757-4
DTXSID	DTXSID501240654
Lokaler Name	6-Chlor-9-(tetrahydro-2H-pyran-2-yl)-9H-purin

Chemische & physikalische Eigenschaften

XLogP	0,8
Polarare Oberfläche (TPSA)	52,8
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	1
Schwere Atome	16
Formalladung	0
Komplexität	255
Schmelzpunkt	149-151℃
Siedepunkt	428.3±55.0 °C(Predicted)
Dichte	1.604
Flammpunkt	213°(415°F)
Brechungsindex	1.7410
Lagerbedingungen	Inert atmosphere,Store in freezer, under -20°C
pKa (Säurekonstante)	0.79±0.10(Predicted)
Aggregatzustand	Solid
Farbe	White to pale yellow
CAS Datenbank	7306-68-5(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Zollcode	2933998090

Anwendungen & Verwendung

Verwenden

6-Chloro-9-(2-tetrahydropyranyl)purine is used to prepare 6-anilino-9-(2-tetrahydropyranyl)purine by reacting with bromobenzene in the presence of potassium amide as a reagent. Further, it serves as an intermediate in organic synthesis and pharmaceuticals.