tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane

C13H26OSi — CID 15849021

IUPACtert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane
SMILESC=CC/C(=C\C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26OSi/c1-8-10-12(9-2)11-14-15(6,7)13(3,4)5/h8-9H,1,10-11H2,2-7H3/b12-9+
InChIKeyDMSCWFPSEKAVRZ-FMIVXFBMSA-N
MW226.44 g/mol
LogP4.53
Rot. Bonds5

About tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane

tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane (PubChem CID 15849021) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane
PubChem CID15849021
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane
SMILESC=CC/C(=C\C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26OSi/c1-8-10-12(9-2)11-14-15(6,7)13(3,4)5/h8-9H,1,10-11H2,2-7H3/b12-9+
InChIKeyDMSCWFPSEKAVRZ-FMIVXFBMSA-N
XLogP4.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.53
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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Related Compounds

Geraniol, tert-butyldimethylsilyl ether
CID 6536899
Geraniol, TMS derivative
CID 10998725
Nerol, trimethylsilyl ether
CID 11817006
4-Hexen-1-ol, (4E)-, tert-butyldimethylsilyl ether
CID 15936622
cis-2-Penten-1-ol, tert-butyldimethylsilyl ether
CID 88150799
cis-2-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 91697283
(2-Cyclopenten-1-yloxy)(triisopropyl)silane
CID 10977584
Farnesol, tert-butyldimethylsilyl ether
CID 10337114
trans-3-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 12010767
Silane, trimethyl(2-pentenyloxy)-, (Z)-
CID 58534801
Dimethyl(bis[(2Z)-pent-2-en-1-yloxy])silane
CID 89941326
cis-3-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 91722567

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane (CID 15849021) is tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane is C=CC/C(=C\C)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane?
The InChIKey is DMSCWFPSEKAVRZ-FMIVXFBMSA-N. The full InChI is InChI=1S/C13H26OSi/c1-8-10-12(9-2)11-14-15(6,7)13(3,4)5/h8-9H,1,10-11H2,2-7H3/b12-9+.
What are the key properties of tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane?
tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.53, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2E)-2-ethylidenepent-4-enoxy]-dimethylsilane is sourced from PubChem (CID 15849021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).