tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane

C11H22O2Si — CID 10398357

IUPACtert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane
SMILESC=CC(O[Si](C)(C)C(C)(C)C)C1CO1
InChIInChI=1S/C11H22O2Si/c1-7-9(10-8-12-10)13-14(5,6)11(2,3)4/h7,9-10H,1,8H2,2-6H3
InChIKeyHUYOMVHCTHMOBH-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.96
Rot. Bonds4

About tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane

tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane (PubChem CID 10398357) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane
PubChem CID10398357
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Nametert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane
SMILESC=CC(O[Si](C)(C)C(C)(C)C)C1CO1
InChIInChI=1S/C11H22O2Si/c1-7-9(10-8-12-10)13-14(5,6)11(2,3)4/h7,9-10H,1,8H2,2-6H3
InChIKeyHUYOMVHCTHMOBH-UHFFFAOYSA-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-[[(2S)-2,3-dihydrofuran-2-yl]methoxy]-dimethylsilane
CID 10608692
tert-butyl-[[(2S,3S)-3-ethenyl-2-methyloxiran-2-yl]methoxy]-dimethylsilane
CID 11160538
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-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
tert-butyl-dimethyl-[(1S)-1-[(2S)-oxiran-2-yl]but-3-enoxy]silane
CID 134963399
trimethyl-[(1S)-1-[(2R)-oxiran-2-yl]prop-2-enoxy]silane
CID 10866807
tert-butyl-dimethyl-[(1S)-1-[(2R)-oxiran-2-yl]prop-2-enoxy]silane
CID 10976828
tert-butyl-[[(2R,3R)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane
CID 11206675
tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane
CID 24806490

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane (CID 10398357) is tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane is C=CC(O[Si](C)(C)C(C)(C)C)C1CO1.
What is the InChIKey of tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane?
The InChIKey is HUYOMVHCTHMOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-7-9(10-8-12-10)13-14(5,6)11(2,3)4/h7,9-10H,1,8H2,2-6H3.
What are the key properties of tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane?
tert-butyl-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane 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-dimethyl-[1-(oxiran-2-yl)prop-2-enoxy]silane is sourced from PubChem (CID 10398357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).