8-bromooct-1-ynyl(trimethyl)silane

C11H21BrSi — CID 46938975

IUPAC8-bromooct-1-ynyl(trimethyl)silane
SMILESC[Si](C)(C)C#CCCCCCCBr
InChIInChI=1S/C11H21BrSi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h4-8,10H2,1-3H3
InChIKeyBFZZPHZNIZJOFU-UHFFFAOYSA-N
MW261.28 g/mol
LogP4.21
Rot. Bonds5

About 8-bromooct-1-ynyl(trimethyl)silane

8-bromooct-1-ynyl(trimethyl)silane (PubChem CID 46938975) has the molecular formula C11H21BrSi and a molecular weight of 261.28 g/mol. Its IUPAC name is 8-bromooct-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Name8-bromooct-1-ynyl(trimethyl)silane
PubChem CID46938975
Molecular FormulaC11H21BrSi
Molecular Weight261.28 g/mol
Exact Mass260.06
IUPAC Name8-bromooct-1-ynyl(trimethyl)silane
SMILESC[Si](C)(C)C#CCCCCCCBr
InChIInChI=1S/C11H21BrSi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h4-8,10H2,1-3H3
InChIKeyBFZZPHZNIZJOFU-UHFFFAOYSA-N
XLogP4.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-bromooct-1-ynyl(trimethyl)silane?
The IUPAC name of 8-bromooct-1-ynyl(trimethyl)silane (CID 46938975) is 8-bromooct-1-ynyl(trimethyl)silane.
What is the SMILES notation for 8-bromooct-1-ynyl(trimethyl)silane?
The canonical SMILES for 8-bromooct-1-ynyl(trimethyl)silane is C[Si](C)(C)C#CCCCCCCBr.
What is the InChIKey of 8-bromooct-1-ynyl(trimethyl)silane?
The InChIKey is BFZZPHZNIZJOFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21BrSi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h4-8,10H2,1-3H3.
What are the key properties of 8-bromooct-1-ynyl(trimethyl)silane?
8-bromooct-1-ynyl(trimethyl)silane has a molecular weight of 261.28 g/mol, XLogP of 4.21, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromooct-1-ynyl(trimethyl)silane is sourced from PubChem (CID 46938975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).