(Hex-1-yn-1-yl)silane

C6H9Si — CID 13112953

IUPAC—
SMILESCCCCC#C[Si]
InChIInChI=1S/C6H9Si/c1-2-3-4-5-6-7/h2-4H2,1H3
InChIKeyJQKLDSHTTRXQMX-UHFFFAOYSA-N
MW109.22 g/mol
LogP1.31
Rot. Bonds2

About (Hex-1-yn-1-yl)silane

(Hex-1-yn-1-yl)silane (PubChem CID 13112953) has the molecular formula C6H9Si and a molecular weight of 109.22 g/mol.

Molecular Properties

Compound Name(Hex-1-yn-1-yl)silane
PubChem CID13112953
Molecular FormulaC6H9Si
Molecular Weight109.22 g/mol
Exact Mass109.05
IUPAC Name—
SMILESCCCCC#C[Si]
InChIInChI=1S/C6H9Si/c1-2-3-4-5-6-7/h2-4H2,1H3
InChIKeyJQKLDSHTTRXQMX-UHFFFAOYSA-N
XLogP1.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.22
LogP ≤ 51.31
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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Related Compounds

pentadeca-5,10-diyne
CID 15530767
tetradeca-4,9-diyne
CID 173328648
methane;bis(oct-3-yne)
CID 159540057
cobalt;hept-2-yne
CID 174831630
1-fluorohex-1-yne
CID 87549340
hex-1-yn-1-amine
CID 15451863
henicos-8-yne
CID 22224321
CID 90985110
CID 90985110
dodeca-4,7-diyne
CID 173074460
trideca-2,8-diyne
CID 90921383
oct-3-yne-1-thiol
CID 150444004
hex-1-ynyl(trimethyl)stannane
CID 10933747

Frequently Asked Questions

What is the IUPAC name of (Hex-1-yn-1-yl)silane?
The IUPAC name of (Hex-1-yn-1-yl)silane (CID 13112953) is not available.
What is the SMILES notation for (Hex-1-yn-1-yl)silane?
The canonical SMILES for (Hex-1-yn-1-yl)silane is CCCCC#C[Si].
What is the InChIKey of (Hex-1-yn-1-yl)silane?
The InChIKey is JQKLDSHTTRXQMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9Si/c1-2-3-4-5-6-7/h2-4H2,1H3.
What are the key properties of (Hex-1-yn-1-yl)silane?
(Hex-1-yn-1-yl)silane has a molecular weight of 109.22 g/mol, XLogP of 1.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Hex-1-yn-1-yl)silane is sourced from PubChem (CID 13112953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).