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

C11H22O2Si — CID 59482156

IUPACtert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane
SMILESC=C[C@@H]1O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-7-9-10(13-9)8-12-14(5,6)11(2,3)4/h7,9-10H,1,8H2,2-6H3/t9-,10+/m0/s1
InChIKeyGPWVGLABDIOHCY-VHSXEESVSA-N
MW214.38 g/mol
LogP2.96
Rot. Bonds4

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

tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane (PubChem CID 59482156) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane
PubChem CID59482156
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Nametert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane
SMILESC=C[C@@H]1O[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-7-9-10(13-9)8-12-14(5,6)11(2,3)4/h7,9-10H,1,8H2,2-6H3/t9-,10+/m0/s1
InChIKeyGPWVGLABDIOHCY-VHSXEESVSA-N
XLogP2.96
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.96
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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-dimethyl-[(2S)-2-[(2R)-oxiran-2-yl]-2-prop-2-enoxyethoxy]silane
CID 10634976
tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane
CID 10708071
tert-butyl-[[(2S,3S)-3-ethenyl-2-methyloxiran-2-yl]methoxy]-dimethylsilane
CID 11160538
trimethyl-[(E)-2-[(2R,3S)-3-methyloxiran-2-yl]ethenyl]silane
CID 11513786
tert-butyl-dimethyl-[(2S,3R)-3-[(3R)-2-methylpent-1-en-3-yl]oxyhex-5-en-2-yl]oxysilane
CID 11551386
tert-butyl-[(1S)-1-[(2R,3S)-3-ethenyloxiran-2-yl]ethoxy]-dimethylsilane
CID 11806435
tert-butyl-dimethyl-[(1R)-1-[(2R)-oxiran-2-yl]prop-2-enoxy]silane
CID 25224257
Tert-butyl-[(3-ethenyloxiran-2-yl)methoxy]-dimethylsilane
CID 72750800
Tert-butyl-(3-ethenyl-2-methyloxiran-2-yl)-dimethylsilane
CID 72974056
Tert-butyl-dimethyl-[(3-prop-1-en-2-yloxiran-2-yl)methoxy]silane
CID 73115515
tert-butyl-dimethyl-[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxysilane
CID 102183142
trimethyl-[(1R)-1-[(2S)-oxiran-2-yl]prop-2-enoxy]silane
CID 134863495

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane (CID 59482156) is tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane is C=C[C@@H]1O[C@@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane?
The InChIKey is GPWVGLABDIOHCY-VHSXEESVSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-7-9-10(13-9)8-12-14(5,6)11(2,3)4/h7,9-10H,1,8H2,2-6H3/t9-,10+/m0/s1.
What are the key properties of tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane?
tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane has a molecular weight of 214.38 g/mol, XLogP of 2.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 59482156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).