tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane

C12H24OSi — CID 15653177

IUPACtert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane
SMILESC=CCC(C=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H24OSi/c1-8-10-11(9-2)13-14(6,7)12(3,4)5/h8-9,11H,1-2,10H2,3-7H3
InChIKeyXDSDYDUSDMDYHT-UHFFFAOYSA-N
MW212.41 g/mol
LogP4.14
Rot. Bonds5

About tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane

tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane (PubChem CID 15653177) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane
PubChem CID15653177
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Nametert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane
SMILESC=CCC(C=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H24OSi/c1-8-10-11(9-2)13-14(6,7)12(3,4)5/h8-9,11H,1-2,10H2,3-7H3
InChIKeyXDSDYDUSDMDYHT-UHFFFAOYSA-N
XLogP4.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane?
The IUPAC name of tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane (CID 15653177) is tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane.
What is the SMILES notation for tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane?
The canonical SMILES for tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane is C=CCC(C=C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane?
The InChIKey is XDSDYDUSDMDYHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24OSi/c1-8-10-11(9-2)13-14(6,7)12(3,4)5/h8-9,11H,1-2,10H2,3-7H3.
What are the key properties of tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane?
tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane has a molecular weight of 212.41 g/mol, XLogP of 4.14, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-hexa-1,5-dien-3-yloxy-dimethylsilane is sourced from PubChem (CID 15653177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).