tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane

C14H30O3Si — CID 57413193

IUPACtert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane
SMILESC=CCC[C@H](CO[Si](C)(C)C(C)(C)C)OCOC
InChIInChI=1S/C14H30O3Si/c1-8-9-10-13(16-12-15-5)11-17-18(6,7)14(2,3)4/h8,13H,1,9-12H2,2-7H3/t13-/m1/s1
InChIKeyRRNBYMXEHVMHOD-CYBMUJFWSA-N
MW274.48 g/mol
LogP3.96
Rot. Bonds9

About tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane

tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane (PubChem CID 57413193) has the molecular formula C14H30O3Si and a molecular weight of 274.48 g/mol. Its IUPAC name is tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane
PubChem CID57413193
Molecular FormulaC14H30O3Si
Molecular Weight274.48 g/mol
Exact Mass274.20
IUPAC Nametert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane
SMILESC=CCC[C@H](CO[Si](C)(C)C(C)(C)C)OCOC
InChIInChI=1S/C14H30O3Si/c1-8-9-10-13(16-12-15-5)11-17-18(6,7)14(2,3)4/h8,13H,1,9-12H2,2-7H3/t13-/m1/s1
InChIKeyRRNBYMXEHVMHOD-CYBMUJFWSA-N
XLogP3.96
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.48
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane (CID 57413193) is tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane is C=CCC[C@H](CO[Si](C)(C)C(C)(C)C)OCOC.
What is the InChIKey of tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane?
The InChIKey is RRNBYMXEHVMHOD-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H30O3Si/c1-8-9-10-13(16-12-15-5)11-17-18(6,7)14(2,3)4/h8,13H,1,9-12H2,2-7H3/t13-/m1/s1.
What are the key properties of tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane?
tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane has a molecular weight of 274.48 g/mol, XLogP of 3.96, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-2-(methoxymethoxy)hex-5-enoxy]-dimethylsilane is sourced from PubChem (CID 57413193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).