[1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane

C11H23BrOSi — CID 19766122

IUPAC[1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1(CCBr)CCCCC1
InChIInChI=1S/C11H23BrOSi/c1-14(2,3)13-11(9-10-12)7-5-4-6-8-11/h4-10H2,1-3H3
InChIKeyXZYCCFYHVJUQCF-UHFFFAOYSA-N
MW279.29 g/mol
LogP4.33
Rot. Bonds4

About [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane

[1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane (PubChem CID 19766122) has the molecular formula C11H23BrOSi and a molecular weight of 279.29 g/mol. Its IUPAC name is [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane
PubChem CID19766122
Molecular FormulaC11H23BrOSi
Molecular Weight279.29 g/mol
Exact Mass278.07
IUPAC Name[1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1(CCBr)CCCCC1
InChIInChI=1S/C11H23BrOSi/c1-14(2,3)13-11(9-10-12)7-5-4-6-8-11/h4-10H2,1-3H3
InChIKeyXZYCCFYHVJUQCF-UHFFFAOYSA-N
XLogP4.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 54.33
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 [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane?
The IUPAC name of [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane (CID 19766122) is [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane.
What is the SMILES notation for [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane?
The canonical SMILES for [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane is C[Si](C)(C)OC1(CCBr)CCCCC1.
What is the InChIKey of [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane?
The InChIKey is XZYCCFYHVJUQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23BrOSi/c1-14(2,3)13-11(9-10-12)7-5-4-6-8-11/h4-10H2,1-3H3.
What are the key properties of [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane?
[1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane has a molecular weight of 279.29 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromoethyl)cyclohexyl]oxy-trimethylsilane is sourced from PubChem (CID 19766122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).