tert-Butylchlordimethylsilan

TBSCL · TBDMSCL · TERT-BUTYLCHLORODIMETHYLSILANE · TBSCI · TBDMSCI · TERT-BUTYLDIMETHYLCHLOROSILANE · T-BUTYLDIMETHYLSILYL CHLORIDE · tert-Butyldimethylsilyl

https://huagongshe.com/de/chemical/28928

Molekülstruktur von tert-Butylchlordimethylsilan

Identifikatoren & physikalische Daten

CAS No.	18162-48-6
Summenformel	C6H15ClSi
Durchschnittliche Molmasse	150,72 g/mol
Monoisotopische Masse	150,06315469 g/mol
SMILES	CC(C)(C)[Si](C)(C)Cl
InChIKey	BCNZYOJHNLTNEZ-UHFFFAOYSA-N
PubChem CID	28928
ChEBI	CHEBI:85071
EC No.	242-042-4
DTXSID	DTXSID4038843
Lokaler Name	tert-Butylchlordimethylsilan

Chemische & physikalische Eigenschaften

Polarare Oberfläche (TPSA)	0
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	0
Frei drehbare Bindungen	1
Schwere Atome	8
Formalladung	0
Komplexität	81
Stoffklassen	Toxic Gases & Vapors -> Chlorosilanes
SpringerMaterials Properties	Schoenflies notation
Physical Description	White hygroscopic solid[Merck Index] White crystals with a pungent odor[Alfa Aesar MSDS]
Schmelzpunkt	86-89 °C (lit.)
Siedepunkt	125 °C (lit.)
Dichte	0.87 g/mL at 20 °C(lit.)
Dampfdruck	60-710Pa at 25℃
Brechungsindex	n20/D 1.46
Flammpunkt	73 °F
Lagerbedingungen	Store below +30°C.
Löslichkeit	very sol nearly all common organic solvents such as THF, methylene chloride, and DMF.Soluble in chloroform and ethyl acetate. Insoluble in water.
Aggregatzustand	white solid
Farbe	white
Wichte	1.225
BRN	505999
InChI	1S/C6H15ClSi/c1-6(2,3)8(4,5)7/h1-5H3
InChIKey	BCNZYOJHNLTNEZ-UHFFFAOYSA-N
SMILES	CC(C)(C)[Si](C)(C)Cl
LogP (Verteilungskoeffizient)	2.5 at 20℃
CAS Datenbank	18162-48-6(CAS DataBase Reference)
NIST chemische Informationen	Silane, chloro(1,1-dimethylethyl)dimethyl-(18162-48-6)
EPA chemische Informationen	Silane, chloro(1,1-dimethylethyl)dimethyl- (18162-48-6)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 23.7% (56 of 236) of reports.DangerH228 (57.6%): Flammable solid [Danger Flammable solids]P210, P240, P241, P260, P261, P264, P264+P265, P271, P273, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P363, P370+P378, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 236 reports by companies from 20 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische Informationen	Chemical: Silane, chloro(1,1-dimethylethyl)dimethyl-Status: Active Update: 30-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/28118Silane, t-butylchlorodimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Gefahrenübersicht	Causes decreased immune response in intraperitoneal lethal-dose studies of mice (LDLo = 1,000 mg/kg)[RTECS] Corrosive[Merck Index] Reacts with water producing hydrochloric acidCauses burnsInhalation may cause corrosive injuries to upper respiratory tract[Alfa Aesar MSDS] See Chlorotrimethylsilane.
Hazard Classes and Categories	Flam. Sol. 1 (57.6%)
Unerwünschte Wirkungen	Dermatotoxin - Skin burns.
F	10-21
Wassergefährdungsklasse (WGK)	2
TSCA-Inventar-Status	TSCA listed
UN-Transportnummer	UN 2925 4.1/PG 2
Zollcode	29310095
RTECS-Nr.	VV2000000
R-Sätze (R)	22-35-40-34-10-19-11-67-65-63-48/20-20/21/22-45-23/24/25-37-36/37/38

Herstellung & Synthese

synthetische

tert-butyldimethylsilyl chloride (TBSCI) was synthesized by the reaction of tert-butyllithium with dichlorodimethylsilane.The pentane solution of dichlorodimethylsilane was cooled to 0°C, and the pentane solution of tert-butyllithium was added dropwise with stirring under nitrogen. The temperature was maintained at 0 °C, stirred for 1.5 h and then heated to 25 °C, and the reaction was continued for 48 h. Distillation, collect 125 ℃ (97.5kPa) fractions, stand to solidify, and obtain tert-butyldimethylsilyl chloride. Yield 70%.