trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane

C7H15Cl3O3Si — CID 87213925

IUPACtrichloro-[3-(1-methoxyethoxymethoxy)propyl]silane
SMILESCOC(C)OCOCCC[Si](Cl)(Cl)Cl
InChIInChI=1S/C7H15Cl3O3Si/c1-7(11-2)13-6-12-4-3-5-14(8,9)10/h7H,3-6H2,1-2H3
InChIKeyHUYOCAYNWRZARU-UHFFFAOYSA-N
MW281.64 g/mol
LogP3.01
Rot. Bonds8

About trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane

trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane (PubChem CID 87213925) has the molecular formula C7H15Cl3O3Si and a molecular weight of 281.64 g/mol. Its IUPAC name is trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane.

Molecular Properties

Compound Nametrichloro-[3-(1-methoxyethoxymethoxy)propyl]silane
PubChem CID87213925
Molecular FormulaC7H15Cl3O3Si
Molecular Weight281.64 g/mol
Exact Mass279.99
IUPAC Nametrichloro-[3-(1-methoxyethoxymethoxy)propyl]silane
SMILESCOC(C)OCOCCC[Si](Cl)(Cl)Cl
InChIInChI=1S/C7H15Cl3O3Si/c1-7(11-2)13-6-12-4-3-5-14(8,9)10/h7H,3-6H2,1-2H3
InChIKeyHUYOCAYNWRZARU-UHFFFAOYSA-N
XLogP3.01
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.64
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane?
The IUPAC name of trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane (CID 87213925) is trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane.
What is the SMILES notation for trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane?
The canonical SMILES for trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane is COC(C)OCOCCC[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane?
The InChIKey is HUYOCAYNWRZARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15Cl3O3Si/c1-7(11-2)13-6-12-4-3-5-14(8,9)10/h7H,3-6H2,1-2H3.
What are the key properties of trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane?
trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane has a molecular weight of 281.64 g/mol, XLogP of 3.01, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[3-(1-methoxyethoxymethoxy)propyl]silane is sourced from PubChem (CID 87213925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).