[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane

C15H30OSi — CID 10531152

IUPAC[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane
SMILESC=C/C=C/CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C15H30OSi/c1-8-9-10-11-12-16-17(13(2)3,14(4)5)15(6)7/h8-10,13-15H,1,11-12H2,2-7H3/b10-9+
InChIKeyOPCRIPDLEFDFQM-MDZDMXLPSA-N
MW254.49 g/mol
LogP5.31
Rot. Bonds8

About [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane

[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane (PubChem CID 10531152) has the molecular formula C15H30OSi and a molecular weight of 254.49 g/mol. Its IUPAC name is [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane
PubChem CID10531152
Molecular FormulaC15H30OSi
Molecular Weight254.49 g/mol
Exact Mass254.21
IUPAC Name[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane
SMILESC=C/C=C/CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C15H30OSi/c1-8-9-10-11-12-16-17(13(2)3,14(4)5)15(6)7/h8-10,13-15H,1,11-12H2,2-7H3/b10-9+
InChIKeyOPCRIPDLEFDFQM-MDZDMXLPSA-N
XLogP5.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.49
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane 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 [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane?
The IUPAC name of [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane (CID 10531152) is [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane.
What is the SMILES notation for [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane?
The canonical SMILES for [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane is C=C/C=C/CCO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane?
The InChIKey is OPCRIPDLEFDFQM-MDZDMXLPSA-N. The full InChI is InChI=1S/C15H30OSi/c1-8-9-10-11-12-16-17(13(2)3,14(4)5)15(6)7/h8-10,13-15H,1,11-12H2,2-7H3/b10-9+.
What are the key properties of [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane?
[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane has a molecular weight of 254.49 g/mol, XLogP of 5.31, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane is sourced from PubChem (CID 10531152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).