6-iodohex-2-ynyl(trimethyl)silane

C9H17ISi — CID 13258746

IUPAC6-iodohex-2-ynyl(trimethyl)silane
SMILESC[Si](C)(C)CC#CCCCI
InChIInChI=1S/C9H17ISi/c1-11(2,3)9-7-5-4-6-8-10/h4,6,8-9H2,1-3H3
InChIKeyGEJFIFLRTKQUGO-UHFFFAOYSA-N
MW280.23 g/mol
LogP3.54
Rot. Bonds3

About 6-iodohex-2-ynyl(trimethyl)silane

6-iodohex-2-ynyl(trimethyl)silane (PubChem CID 13258746) has the molecular formula C9H17ISi and a molecular weight of 280.23 g/mol. Its IUPAC name is 6-iodohex-2-ynyl(trimethyl)silane.

Molecular Properties

Compound Name6-iodohex-2-ynyl(trimethyl)silane
PubChem CID13258746
Molecular FormulaC9H17ISi
Molecular Weight280.23 g/mol
Exact Mass280.01
IUPAC Name6-iodohex-2-ynyl(trimethyl)silane
SMILESC[Si](C)(C)CC#CCCCI
InChIInChI=1S/C9H17ISi/c1-11(2,3)9-7-5-4-6-8-10/h4,6,8-9H2,1-3H3
InChIKeyGEJFIFLRTKQUGO-UHFFFAOYSA-N
XLogP3.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.23
LogP ≤ 53.54
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': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-iodohex-2-ynyl(trimethyl)silane?
The IUPAC name of 6-iodohex-2-ynyl(trimethyl)silane (CID 13258746) is 6-iodohex-2-ynyl(trimethyl)silane.
What is the SMILES notation for 6-iodohex-2-ynyl(trimethyl)silane?
The canonical SMILES for 6-iodohex-2-ynyl(trimethyl)silane is C[Si](C)(C)CC#CCCCI.
What is the InChIKey of 6-iodohex-2-ynyl(trimethyl)silane?
The InChIKey is GEJFIFLRTKQUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17ISi/c1-11(2,3)9-7-5-4-6-8-10/h4,6,8-9H2,1-3H3.
What are the key properties of 6-iodohex-2-ynyl(trimethyl)silane?
6-iodohex-2-ynyl(trimethyl)silane has a molecular weight of 280.23 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-iodohex-2-ynyl(trimethyl)silane is sourced from PubChem (CID 13258746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).