4-Bromobenzyloxy-tert-butyldimethylsilane

HCID 10859583CAS 87736-74-1

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Basic information

Standard SMILES: CC(C)(C)[Si](C)(C)OCc1ccc(Br)cc1
InChIKey: OURCJXVOBHLREF-UHFFFAOYSA-N
Molecular formula: C13H21BrOSi
Average molar mass: 301.29 g/mol
Monoisotopic mass: 300.05450392

Names & identifiers

Preferred name: 4-Bromobenzyloxy-tert-butyldimethylsilane
IUPAC: (4-bromophenyl)methoxy-tert-butyl-dimethylsilane
English name: (4-Bromophenyl)methoxy-tert-butyl-dimethylsilane
Molecular formula: C13H21BrOSi
Molecular weight: 301.29

Names & synonyms

87736-74-14-bromobenzyloxy-tert-butyldimethylsilaneDTXSID40446206RefChem:1070431DTXCID40397027((4-Bromobenzyl)oxy)(tert-butyl)dimethylsilane4-Tbdms-Hydroxymethylbromobenzene4-(tert-Butyldimethylsilyloxymethyl)bromobenzene[(4-bromobenzyl)oxy](tert-butyl)dimethylsilane[(4-bromophenyl)methoxy](tert-butyl)dimethylsilaneMFCD07368899(4-bromophenyl)methoxy-tert-butyl-dimethylsilane

Show more names

4-BroMobenzyl diMethyl-tert-butylsilyl Ether(4-BroMobenzyl)oxy](tert-butyl)diMethylsilane1-Bromo-4-[[(tert-butyldimethylsilyl)oxy]methyl]benzene1-BroMo-4-[[[(1,1-diMethylethyl)diMethylsilyl]oxy]Methyl]-benzene

Benzene, 1-bromo-4-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-[(4-bromobenzyl)oxy](t-butyl)dimethylsilane4-Bromobenzyl dimethyl-tert-butylsilyl Ether; (4-Bromobenzyl)oxy](tert-butyl)dimethylsilane; 1-Bromo-4-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-benzeneFT-0651020(4-bromo-benzyloxy)-tert-butyl-dimethyl-silaneSCHEMBL481257SY055AKOS015841199

Database identifiers

CAS: 87736-74-1
PubChem CID: 10859583
DTXSID: DTXSID40446206
Nikkaji: J978.426H

Properties

Computed structural properties

Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 214

Physicochemical properties

Boiling point: 160 °C/0.3 · 160 °C/0.3 mmHg
Density: 1.145 · 1.145
refractive index: 1.51 · 1.51
storage temp.: 2 · 2-8°C
solubility: Dichloromethane, Diethyl Ether, Methanol
form: Oil
color: Colorless
HS Code: 2931.9 · 2931.90.9051

Safety & regulation

Safety data

hs_code: 2931.90.9051

Chemistry & industry

Applications

Uses(4-bromophenyl)methoxy-tert-butyl-dimethylsilane is used in the preparation of aromatic bisphosphonates as inhibitors of geranylgeranyl diphosphate synthase.