5-chloropentyl(trimethoxy)silane

C8H19ClO3Si — CID 20549062

IUPAC5-chloropentyl(trimethoxy)silane
SMILESCO[Si](CCCCCCl)(OC)OC
InChIInChI=1S/C8H19ClO3Si/c1-10-13(11-2,12-3)8-6-4-5-7-9/h4-8H2,1-3H3
InChIKeyISDLUAFVTUMMRJ-UHFFFAOYSA-N
MW226.78 g/mol
LogP2.27
Rot. Bonds8

About 5-chloropentyl(trimethoxy)silane

5-chloropentyl(trimethoxy)silane (PubChem CID 20549062) has the molecular formula C8H19ClO3Si and a molecular weight of 226.78 g/mol. Its IUPAC name is 5-chloropentyl(trimethoxy)silane.

Molecular Properties

Compound Name5-chloropentyl(trimethoxy)silane
PubChem CID20549062
Molecular FormulaC8H19ClO3Si
Molecular Weight226.78 g/mol
Exact Mass226.08
IUPAC Name5-chloropentyl(trimethoxy)silane
SMILESCO[Si](CCCCCCl)(OC)OC
InChIInChI=1S/C8H19ClO3Si/c1-10-13(11-2,12-3)8-6-4-5-7-9/h4-8H2,1-3H3
InChIKeyISDLUAFVTUMMRJ-UHFFFAOYSA-N
XLogP2.27
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.78
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}

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Frequently Asked Questions

What is the IUPAC name of 5-chloropentyl(trimethoxy)silane?
The IUPAC name of 5-chloropentyl(trimethoxy)silane (CID 20549062) is 5-chloropentyl(trimethoxy)silane.
What is the SMILES notation for 5-chloropentyl(trimethoxy)silane?
The canonical SMILES for 5-chloropentyl(trimethoxy)silane is CO[Si](CCCCCCl)(OC)OC.
What is the InChIKey of 5-chloropentyl(trimethoxy)silane?
The InChIKey is ISDLUAFVTUMMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19ClO3Si/c1-10-13(11-2,12-3)8-6-4-5-7-9/h4-8H2,1-3H3.
What are the key properties of 5-chloropentyl(trimethoxy)silane?
5-chloropentyl(trimethoxy)silane has a molecular weight of 226.78 g/mol, XLogP of 2.27, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloropentyl(trimethoxy)silane is sourced from PubChem (CID 20549062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).