tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane

C13H26O3Si — CID 22298162

IUPACtert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane
SMILESC=C1C[C@@H](OC)O[C@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O3Si/c1-10-8-12(14-5)16-11(10)9-15-17(6,7)13(2,3)4/h11-12H,1,8-9H2,2-7H3/t11-,12-/m0/s1
InChIKeyYWMSVZDHXDVKEQ-RYUDHWBXSA-N
MW258.43 g/mol
LogP3.33
Rot. Bonds4

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

tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane (PubChem CID 22298162) has the molecular formula C13H26O3Si and a molecular weight of 258.43 g/mol. Its IUPAC name is tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane
PubChem CID22298162
Molecular FormulaC13H26O3Si
Molecular Weight258.43 g/mol
Exact Mass258.17
IUPAC Nametert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane
SMILESC=C1C[C@@H](OC)O[C@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O3Si/c1-10-8-12(14-5)16-11(10)9-15-17(6,7)13(2,3)4/h11-12H,1,8-9H2,2-7H3/t11-,12-/m0/s1
InChIKeyYWMSVZDHXDVKEQ-RYUDHWBXSA-N
XLogP3.33
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane (CID 22298162) is tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane is C=C1C[C@@H](OC)O[C@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane?
The InChIKey is YWMSVZDHXDVKEQ-RYUDHWBXSA-N. The full InChI is InChI=1S/C13H26O3Si/c1-10-8-12(14-5)16-11(10)9-15-17(6,7)13(2,3)4/h11-12H,1,8-9H2,2-7H3/t11-,12-/m0/s1.
What are the key properties of tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane?
tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane has a molecular weight of 258.43 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2R,5S)-5-methoxy-3-methylideneoxolan-2-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 22298162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).