hex-1-ynyl(trimethyl)silane

C9H18Si — CID 586959

IUPAChex-1-ynyl(trimethyl)silane
SMILESCCCCC#C[Si](C)(C)C
InChIInChI=1S/C9H18Si/c1-5-6-7-8-9-10(2,3)4/h5-7H2,1-4H3
InChIKeySFCRJYVNDZSYCT-UHFFFAOYSA-N
MW154.33 g/mol
LogP3.06
Rot. Bonds2

About hex-1-ynyl(trimethyl)silane

hex-1-ynyl(trimethyl)silane (PubChem CID 586959) has the molecular formula C9H18Si and a molecular weight of 154.33 g/mol. Its IUPAC name is hex-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Namehex-1-ynyl(trimethyl)silane
PubChem CID586959
Molecular FormulaC9H18Si
Molecular Weight154.33 g/mol
Exact Mass154.12
IUPAC Namehex-1-ynyl(trimethyl)silane
SMILESCCCCC#C[Si](C)(C)C
InChIInChI=1S/C9H18Si/c1-5-6-7-8-9-10(2,3)4/h5-7H2,1-4H3
InChIKeySFCRJYVNDZSYCT-UHFFFAOYSA-N
XLogP3.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.33
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 hex-1-ynyl(trimethyl)silane?
The IUPAC name of hex-1-ynyl(trimethyl)silane (CID 586959) is hex-1-ynyl(trimethyl)silane.
What is the SMILES notation for hex-1-ynyl(trimethyl)silane?
The canonical SMILES for hex-1-ynyl(trimethyl)silane is CCCCC#C[Si](C)(C)C.
What is the InChIKey of hex-1-ynyl(trimethyl)silane?
The InChIKey is SFCRJYVNDZSYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18Si/c1-5-6-7-8-9-10(2,3)4/h5-7H2,1-4H3.
What are the key properties of hex-1-ynyl(trimethyl)silane?
hex-1-ynyl(trimethyl)silane has a molecular weight of 154.33 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hex-1-ynyl(trimethyl)silane is sourced from PubChem (CID 586959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).