(1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane

C10H23BrOSi — CID 19425332

IUPAC(1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane
SMILESCCC(CC)(CCBr)O[Si](C)(C)C
InChIInChI=1S/C10H23BrOSi/c1-6-10(7-2,8-9-11)12-13(3,4)5/h6-9H2,1-5H3
InChIKeySFQHJOKNKUGPHK-UHFFFAOYSA-N
MW267.28 g/mol
LogP4.18
Rot. Bonds6

About (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane

(1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane (PubChem CID 19425332) has the molecular formula C10H23BrOSi and a molecular weight of 267.28 g/mol. Its IUPAC name is (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane
PubChem CID19425332
Molecular FormulaC10H23BrOSi
Molecular Weight267.28 g/mol
Exact Mass266.07
IUPAC Name(1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane
SMILESCCC(CC)(CCBr)O[Si](C)(C)C
InChIInChI=1S/C10H23BrOSi/c1-6-10(7-2,8-9-11)12-13(3,4)5/h6-9H2,1-5H3
InChIKeySFQHJOKNKUGPHK-UHFFFAOYSA-N
XLogP4.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 54.18
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-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane?
The IUPAC name of (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane (CID 19425332) is (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane.
What is the SMILES notation for (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane?
The canonical SMILES for (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane is CCC(CC)(CCBr)O[Si](C)(C)C.
What is the InChIKey of (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane?
The InChIKey is SFQHJOKNKUGPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23BrOSi/c1-6-10(7-2,8-9-11)12-13(3,4)5/h6-9H2,1-5H3.
What are the key properties of (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane?
(1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane has a molecular weight of 267.28 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-bromo-3-ethylpentan-3-yl)oxy-trimethylsilane is sourced from PubChem (CID 19425332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).