bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane

C11H22O3Si — CID 14658516

IUPACbis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC([C@@H]1CO1)[C@@H]1CO1
InChIInChI=1S/C11H22O3Si/c1-11(2,3)15(4,5)14-10(8-6-12-8)9-7-13-9/h8-10H,6-7H2,1-5H3/t8-,9-/m0/s1
InChIKeyUJJHSQNXOITNNC-IUCAKERBSA-N
MW230.38 g/mol
LogP2.17
Rot. Bonds4

About bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane

bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane (PubChem CID 14658516) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Namebis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane
PubChem CID14658516
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Namebis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC([C@@H]1CO1)[C@@H]1CO1
InChIInChI=1S/C11H22O3Si/c1-11(2,3)15(4,5)14-10(8-6-12-8)9-7-13-9/h8-10H,6-7H2,1-5H3/t8-,9-/m0/s1
InChIKeyUJJHSQNXOITNNC-IUCAKERBSA-N
XLogP2.17
TPSA34.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane?
The IUPAC name of bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane (CID 14658516) is bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)OC([C@@H]1CO1)[C@@H]1CO1.
What is the InChIKey of bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane?
The InChIKey is UJJHSQNXOITNNC-IUCAKERBSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-11(2,3)15(4,5)14-10(8-6-12-8)9-7-13-9/h8-10H,6-7H2,1-5H3/t8-,9-/m0/s1.
What are the key properties of bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane?
bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane has a molecular weight of 230.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(2S)-oxiran-2-yl]methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 14658516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).