[(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane

C12H26O3Si2 — CID 91720332

IUPAC[(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane
SMILESC/C=C/CO[Si](C)(C)O[Si](C)(C)OC/C=C/C
InChIInChI=1S/C12H26O3Si2/c1-7-9-11-13-16(3,4)15-17(5,6)14-12-10-8-2/h7-10H,11-12H2,1-6H3/b9-7+,10-8+
InChIKeyPVXYZEKSBZHNCP-FIFLTTCUSA-N
MW274.51 g/mol
LogP3.59
Rot. Bonds8

About [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane

[(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane (PubChem CID 91720332) has the molecular formula C12H26O3Si2 and a molecular weight of 274.51 g/mol. Its IUPAC name is [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane.

Molecular Properties

Compound Name[(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane
PubChem CID91720332
Molecular FormulaC12H26O3Si2
Molecular Weight274.51 g/mol
Exact Mass274.14
IUPAC Name[(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane
SMILESC/C=C/CO[Si](C)(C)O[Si](C)(C)OC/C=C/C
InChIInChI=1S/C12H26O3Si2/c1-7-9-11-13-16(3,4)15-17(5,6)14-12-10-8-2/h7-10H,11-12H2,1-6H3/b9-7+,10-8+
InChIKeyPVXYZEKSBZHNCP-FIFLTTCUSA-N
XLogP3.59
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.51
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-Trimethylsiloxy-2-butene
CID 5366916
3,8-Dioxa-2,9-disiladec-5-ene, 2,2,9,9-tetramethyl-, (E)-
CID 5366600
trans-Crotyl alcohol, tert-butyldimethylsilyl ether
CID 11217677
3,10-Dioxa-2,11-disiladodeca-5,7-diene, 2,2,11,11-tetramethyl-
CID 5366452
Prenol, TMS derivative
CID 6421205
1,1-Diethoxy-1-silacyclo-3-pentene
CID 144205
But-2-enoxy(trimethyl)silane
CID 554664
Dimethylbis[(prop-2-en-1-yl)oxy]silane
CID 14637786
(5Z)-2,2,9,9-Tetramethyl-3,8-dioxa-2,9-disiladec-5-ene
CID 5372908
2-Butene-1,4-diol, 2TBDMS derivative
CID 11141643
Dimethyl(bis[(2Z)-pent-2-en-1-yloxy])silane
CID 89941326
Dimethyl(bis[(3-methylbut-2-en-1-yl)oxy])silane
CID 91697225

Frequently Asked Questions

What is the IUPAC name of [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane?
The IUPAC name of [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane (CID 91720332) is [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane.
What is the SMILES notation for [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane?
The canonical SMILES for [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane is C/C=C/CO[Si](C)(C)O[Si](C)(C)OC/C=C/C.
What is the InChIKey of [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane?
The InChIKey is PVXYZEKSBZHNCP-FIFLTTCUSA-N. The full InChI is InChI=1S/C12H26O3Si2/c1-7-9-11-13-16(3,4)15-17(5,6)14-12-10-8-2/h7-10H,11-12H2,1-6H3/b9-7+,10-8+.
What are the key properties of [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane?
[(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane has a molecular weight of 274.51 g/mol, XLogP of 3.59, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-but-2-enoxy]-[[(E)-but-2-enoxy]-dimethylsilyl]oxy-dimethylsilane is sourced from PubChem (CID 91720332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).