tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane

C15H32O3Si — CID 11781213

IUPACtert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane
SMILESC=CC[C@@H](CCCO[Si](C)(C)C(C)(C)C)OCOC
InChIInChI=1S/C15H32O3Si/c1-8-10-14(17-13-16-5)11-9-12-18-19(6,7)15(2,3)4/h8,14H,1,9-13H2,2-7H3/t14-/m0/s1
InChIKeyZHTNJGUGNTTZQV-AWEZNQCLSA-N
MW288.50 g/mol
LogP4.35
Rot. Bonds10

About tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane

tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane (PubChem CID 11781213) has the molecular formula C15H32O3Si and a molecular weight of 288.50 g/mol. Its IUPAC name is tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane
PubChem CID11781213
Molecular FormulaC15H32O3Si
Molecular Weight288.50 g/mol
Exact Mass288.21
IUPAC Nametert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane
SMILESC=CC[C@@H](CCCO[Si](C)(C)C(C)(C)C)OCOC
InChIInChI=1S/C15H32O3Si/c1-8-10-14(17-13-16-5)11-9-12-18-19(6,7)15(2,3)4/h8,14H,1,9-13H2,2-7H3/t14-/m0/s1
InChIKeyZHTNJGUGNTTZQV-AWEZNQCLSA-N
XLogP4.35
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.50
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[2-[[(2R)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxymethoxy]ethyl]silane
CID 13969334
tert-butyl-[(3S,4R)-3-(methoxymethoxy)-4-methylhex-5-enoxy]-dimethylsilane
CID 15981704
tert-butyl-[(2S,4S)-4-(methoxymethoxy)hept-6-en-2-yl]oxy-dimethylsilane
CID 46218224
tert-butyl-[(2R,5R)-5-(methoxymethoxy)hept-6-en-2-yl]oxy-dimethylsilane
CID 49871721
tert-butyl-[(4S,6S)-6-(methoxymethoxy)undec-1-en-4-yl]oxy-dimethylsilane
CID 57326345
tert-butyl-[(2S,5S)-5-(methoxymethoxy)hept-6-en-2-yl]oxy-dimethylsilane
CID 134859667
trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane
CID 134894371
tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane
CID 135039837
tert-butyl-[(4S,5S)-4-(methoxymethoxy)-5-tri(propan-2-yl)silyloxyhept-6-enoxy]-dimethylsilane
CID 139252210
tert-butyl-[(4S)-4-(methoxymethoxy)hex-5-enoxy]-dimethylsilane
CID 89996374
tert-butyl-[(2S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]pent-4-en-2-yl]oxy-dimethylsilane
CID 10357472
tert-butyl-[(2S,3S,4S)-3-(methoxymethoxy)-2,4-dimethylhept-6-enoxy]-dimethylsilane
CID 11278528

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane (CID 11781213) is tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane is C=CC[C@@H](CCCO[Si](C)(C)C(C)(C)C)OCOC.
What is the InChIKey of tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane?
The InChIKey is ZHTNJGUGNTTZQV-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H32O3Si/c1-8-10-14(17-13-16-5)11-9-12-18-19(6,7)15(2,3)4/h8,14H,1,9-13H2,2-7H3/t14-/m0/s1.
What are the key properties of tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane?
tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane has a molecular weight of 288.50 g/mol, XLogP of 4.35, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane is sourced from PubChem (CID 11781213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).