3-chloroprop-1-ynyl(triethyl)silane

C9H17ClSi — CID 13162530

IUPAC3-chloroprop-1-ynyl(triethyl)silane
SMILESCC[Si](C#CCCl)(CC)CC
InChIInChI=1S/C9H17ClSi/c1-4-11(5-2,6-3)9-7-8-10/h4-6,8H2,1-3H3
InChIKeyLUSHFGWWGTVFEV-UHFFFAOYSA-N
MW188.77 g/mol
LogP3.28
Rot. Bonds3

About 3-chloroprop-1-ynyl(triethyl)silane

3-chloroprop-1-ynyl(triethyl)silane (PubChem CID 13162530) has the molecular formula C9H17ClSi and a molecular weight of 188.77 g/mol. Its IUPAC name is 3-chloroprop-1-ynyl(triethyl)silane.

Molecular Properties

Compound Name3-chloroprop-1-ynyl(triethyl)silane
PubChem CID13162530
Molecular FormulaC9H17ClSi
Molecular Weight188.77 g/mol
Exact Mass188.08
IUPAC Name3-chloroprop-1-ynyl(triethyl)silane
SMILESCC[Si](C#CCCl)(CC)CC
InChIInChI=1S/C9H17ClSi/c1-4-11(5-2,6-3)9-7-8-10/h4-6,8H2,1-3H3
InChIKeyLUSHFGWWGTVFEV-UHFFFAOYSA-N
XLogP3.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.77
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 3-chloroprop-1-ynyl(triethyl)silane?
The IUPAC name of 3-chloroprop-1-ynyl(triethyl)silane (CID 13162530) is 3-chloroprop-1-ynyl(triethyl)silane.
What is the SMILES notation for 3-chloroprop-1-ynyl(triethyl)silane?
The canonical SMILES for 3-chloroprop-1-ynyl(triethyl)silane is CC[Si](C#CCCl)(CC)CC.
What is the InChIKey of 3-chloroprop-1-ynyl(triethyl)silane?
The InChIKey is LUSHFGWWGTVFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17ClSi/c1-4-11(5-2,6-3)9-7-8-10/h4-6,8H2,1-3H3.
What are the key properties of 3-chloroprop-1-ynyl(triethyl)silane?
3-chloroprop-1-ynyl(triethyl)silane has a molecular weight of 188.77 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloroprop-1-ynyl(triethyl)silane is sourced from PubChem (CID 13162530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).