2-bromoethoxy-tert-butyl-dimethylsilane

C8H19BrOSi — CID 3608067

IUPAC2-bromoethoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCBr
InChIInChI=1S/C8H19BrOSi/c1-8(2,3)11(4,5)10-7-6-9/h6-7H2,1-5H3
InChIKeyJBKINHFZTVLNEM-UHFFFAOYSA-N
MW239.23 g/mol
LogP3.40
Rot. Bonds3

About 2-bromoethoxy-tert-butyl-dimethylsilane

2-bromoethoxy-tert-butyl-dimethylsilane (PubChem CID 3608067) has the molecular formula C8H19BrOSi and a molecular weight of 239.23 g/mol. Its IUPAC name is 2-bromoethoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name2-bromoethoxy-tert-butyl-dimethylsilane
PubChem CID3608067
Molecular FormulaC8H19BrOSi
Molecular Weight239.23 g/mol
Exact Mass238.04
IUPAC Name2-bromoethoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCBr
InChIInChI=1S/C8H19BrOSi/c1-8(2,3)11(4,5)10-7-6-9/h6-7H2,1-5H3
InChIKeyJBKINHFZTVLNEM-UHFFFAOYSA-N
XLogP3.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-bromoethoxy-tert-butyl-dimethylsilane?
The IUPAC name of 2-bromoethoxy-tert-butyl-dimethylsilane (CID 3608067) is 2-bromoethoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for 2-bromoethoxy-tert-butyl-dimethylsilane?
The canonical SMILES for 2-bromoethoxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)OCCBr.
What is the InChIKey of 2-bromoethoxy-tert-butyl-dimethylsilane?
The InChIKey is JBKINHFZTVLNEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19BrOSi/c1-8(2,3)11(4,5)10-7-6-9/h6-7H2,1-5H3.
What are the key properties of 2-bromoethoxy-tert-butyl-dimethylsilane?
2-bromoethoxy-tert-butyl-dimethylsilane has a molecular weight of 239.23 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromoethoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 3608067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).