tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane

C23H48O2Si2 — CID 135072279

IUPACtert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane
SMILESC=CCC(CC=C)(COC[Si](C)(C)C(C)(C)C)COC[Si](C)(C)C(C)(C)C
InChIInChI=1S/C23H48O2Si2/c1-13-15-23(16-14-2,17-24-19-26(9,10)21(3,4)5)18-25-20-27(11,12)22(6,7)8/h13-14H,1-2,15-20H2,3-12H3
InChIKeyPHSVJGRNUJCEMB-UHFFFAOYSA-N
MW412.81 g/mol
LogP7.25
Rot. Bonds12

About tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane

tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane (PubChem CID 135072279) has the molecular formula C23H48O2Si2 and a molecular weight of 412.81 g/mol. Its IUPAC name is tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane
PubChem CID135072279
Molecular FormulaC23H48O2Si2
Molecular Weight412.81 g/mol
Exact Mass412.32
IUPAC Nametert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane
SMILESC=CCC(CC=C)(COC[Si](C)(C)C(C)(C)C)COC[Si](C)(C)C(C)(C)C
InChIInChI=1S/C23H48O2Si2/c1-13-15-23(16-14-2,17-24-19-26(9,10)21(3,4)5)18-25-20-27(11,12)22(6,7)8/h13-14H,1-2,15-20H2,3-12H3
InChIKeyPHSVJGRNUJCEMB-UHFFFAOYSA-N
XLogP7.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.81
LogP ≤ 57.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

Tert-butyl-(6-methoxy-3,3-dimethylhex-5-enoxy)-dimethylsilane
CID 134971449
Tri(propan-2-yl)-[2-prop-2-ynyl-2-[tri(propan-2-yl)silyloxymethyl]pent-4-enoxy]silane
CID 164665054
Diethoxy-(2-ethyl-2-prop-2-enylpent-4-enoxy)-prop-2-enylsilane
CID 175537173
Tert-butyl-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-prop-2-enylpent-4-enoxy]-dimethylsilane
CID 11749450
Silane, [4,4-bis(methoxymethyl)-6-hepten-1-ynyl]trimethyl-
CID 12118397
tert-butyl-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpent-4-enoxy]-dimethylsilane
CID 15230526
2-Prop-2-enyl-2-[tri(propan-2-yl)silyloxymethyl]pent-4-en-1-ol
CID 44556698
Tert-butyl-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-prop-2-ynylpent-4-enoxy]-dimethylsilane
CID 60201382
Trimethyl-[2-prop-2-enyl-2-(trimethylsilyloxymethyl)pent-4-enoxy]silane
CID 102122114

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane?
The IUPAC name of tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane (CID 135072279) is tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane is C=CCC(CC=C)(COC[Si](C)(C)C(C)(C)C)COC[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane?
The InChIKey is PHSVJGRNUJCEMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48O2Si2/c1-13-15-23(16-14-2,17-24-19-26(9,10)21(3,4)5)18-25-20-27(11,12)22(6,7)8/h13-14H,1-2,15-20H2,3-12H3.
What are the key properties of tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane?
tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane has a molecular weight of 412.81 g/mol, XLogP of 7.25, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]methoxymethyl]-2-prop-2-enylpent-4-enoxy]methyl]-dimethylsilane is sourced from PubChem (CID 135072279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).