[(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'}

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Related Compounds

zinc bis([(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane)
CID 10531151
triethoxy(octa-5,7-dien-2-yl)silane
CID 87891599
(3E,7E)-9-methyldeca-1,3,7-triene
CID 101414428
(E)-2-methyl-5-tri(propan-2-yl)silyloxypent-2-enal
CID 102371780
[(3E)-hexa-3,5-dienoxy]-methylphosphinic acid
CID 20726647
(3Z)-hepta-1,3-diene
CID 6427773
7-octa-5,7-dien-2-ylsulfanylocta-1,3-diene
CID 154245049
6-chlorohexoxy-tri(propan-2-yl)silane
CID 89400729
9-methylundeca-1,3,7,10-tetraene
CID 154197788
bis((3E)-octa-1,3-diene);ruthenium
CID 173228817
11-methyldodeca-1,3-diene
CID 154156925
trimethyl-[(15E)-octadeca-15,17-dienyl]phosphanium
CID 101109490

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).