tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane

C16H32O2Si — CID 11161923

IUPACtert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane
SMILESCC1=C[C@@H](C(C)(C)C)O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-12-10-14(15(2,3)4)18-13(12)11-17-19(8,9)16(5,6)7/h10,13-14H,11H2,1-9H3/t13-,14+/m1/s1
InChIKeyQURIGDDUFSQHSL-KGLIPLIRSA-N
MW284.52 g/mol
LogP4.77
Rot. Bonds3

About tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane

tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane (PubChem CID 11161923) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane
PubChem CID11161923
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Nametert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane
SMILESCC1=C[C@@H](C(C)(C)C)O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-12-10-14(15(2,3)4)18-13(12)11-17-19(8,9)16(5,6)7/h10,13-14H,11H2,1-9H3/t13-,14+/m1/s1
InChIKeyQURIGDDUFSQHSL-KGLIPLIRSA-N
XLogP4.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.77
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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane (CID 11161923) is tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane is CC1=C[C@@H](C(C)(C)C)O[C@@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane?
The InChIKey is QURIGDDUFSQHSL-KGLIPLIRSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-12-10-14(15(2,3)4)18-13(12)11-17-19(8,9)16(5,6)7/h10,13-14H,11H2,1-9H3/t13-,14+/m1/s1.
What are the key properties of tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane?
tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane has a molecular weight of 284.52 g/mol, XLogP of 4.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2S,5S)-5-tert-butyl-3-methyl-2,5-dihydrofuran-2-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 11161923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).