tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane

C14H28OSi — CID 15849016

IUPACtert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane
SMILESC=CC/C=C(\C)CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H28OSi/c1-8-9-10-13(2)11-12-15-16(6,7)14(3,4)5/h8,10H,1,9,11-12H2,2-7H3/b13-10+
InChIKeyYFOQXORYLSVVFZ-JLHYYAGUSA-N
MW240.46 g/mol
LogP4.92
Rot. Bonds6

About tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane

tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane (PubChem CID 15849016) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane
PubChem CID15849016
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Nametert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane
SMILESC=CC/C=C(\C)CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H28OSi/c1-8-9-10-13(2)11-12-15-16(6,7)14(3,4)5/h8,10H,1,9,11-12H2,2-7H3/b13-10+
InChIKeyYFOQXORYLSVVFZ-JLHYYAGUSA-N
XLogP4.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
LogP ≤ 54.92
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

Trimethyl[[(1E,3E)-2-methylpenta-1,3-dien-1-yl]oxy]silane
CID 10964963
(But-3-enyloxy)(tert-butyl)dimethylsilane
CID 10008065
Silane, (1,1-dimethylethyl)dimethyl[(3-methyl-3-butenyl)oxy]-
CID 10954590
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
trans-3-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 12010767
cis-3-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 91722567
tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane
CID 10987644
tert-Butyl(hepta-3,6-dienyloxy)dimethylsilane
CID 14214598
tert-butyl-[(Z)-hex-4-enoxy]-dimethylsilane
CID 162397527
3-Methylbut-3-enoxy-tri(propan-2-yl)silane
CID 15940579

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane (CID 15849016) is tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane is C=CC/C=C(\C)CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane?
The InChIKey is YFOQXORYLSVVFZ-JLHYYAGUSA-N. The full InChI is InChI=1S/C14H28OSi/c1-8-9-10-13(2)11-12-15-16(6,7)14(3,4)5/h8,10H,1,9,11-12H2,2-7H3/b13-10+.
What are the key properties of tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane?
tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane has a molecular weight of 240.46 g/mol, XLogP of 4.92, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3E)-3-methylhepta-3,6-dienoxy]silane is sourced from PubChem (CID 15849016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).