3-(4,4-dimethylpentoxy)propoxysilane

C10H24O2Si — CID 123352079

IUPAC3-(4,4-dimethylpentoxy)propoxysilane
SMILESCC(C)(C)CCCOCCCO[SiH3]
InChIInChI=1S/C10H24O2Si/c1-10(2,3)6-4-7-11-8-5-9-12-13/h4-9H2,1-3,13H3
InChIKeyLAUFTTNHVDKIRB-UHFFFAOYSA-N
MW204.39 g/mol
LogP1.52
Rot. Bonds7

About 3-(4,4-dimethylpentoxy)propoxysilane

3-(4,4-dimethylpentoxy)propoxysilane (PubChem CID 123352079) has the molecular formula C10H24O2Si and a molecular weight of 204.39 g/mol. Its IUPAC name is 3-(4,4-dimethylpentoxy)propoxysilane.

Molecular Properties

Compound Name3-(4,4-dimethylpentoxy)propoxysilane
PubChem CID123352079
Molecular FormulaC10H24O2Si
Molecular Weight204.39 g/mol
Exact Mass204.15
IUPAC Name3-(4,4-dimethylpentoxy)propoxysilane
SMILESCC(C)(C)CCCOCCCO[SiH3]
InChIInChI=1S/C10H24O2Si/c1-10(2,3)6-4-7-11-8-5-9-12-13/h4-9H2,1-3,13H3
InChIKeyLAUFTTNHVDKIRB-UHFFFAOYSA-N
XLogP1.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.39
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 3-(4,4-dimethylpentoxy)propoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4,4-dimethylpentoxy)propoxysilane?
The IUPAC name of 3-(4,4-dimethylpentoxy)propoxysilane (CID 123352079) is 3-(4,4-dimethylpentoxy)propoxysilane.
What is the SMILES notation for 3-(4,4-dimethylpentoxy)propoxysilane?
The canonical SMILES for 3-(4,4-dimethylpentoxy)propoxysilane is CC(C)(C)CCCOCCCO[SiH3].
What is the InChIKey of 3-(4,4-dimethylpentoxy)propoxysilane?
The InChIKey is LAUFTTNHVDKIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O2Si/c1-10(2,3)6-4-7-11-8-5-9-12-13/h4-9H2,1-3,13H3.
What are the key properties of 3-(4,4-dimethylpentoxy)propoxysilane?
3-(4,4-dimethylpentoxy)propoxysilane has a molecular weight of 204.39 g/mol, XLogP of 1.52, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-dimethylpentoxy)propoxysilane is sourced from PubChem (CID 123352079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).