tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate

C15H30O4Si — CID 59981766

IUPACtert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate
SMILESC=C(COC(=O)OC(C)(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H30O4Si/c1-12(10-17-13(16)19-14(2,3)4)11-18-20(8,9)15(5,6)7/h1,10-11H2,2-9H3
InChIKeyWVOLHBDOTNTQBE-UHFFFAOYSA-N
MW302.49 g/mol
LogP4.52
Rot. Bonds5

About tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate

tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate (PubChem CID 59981766) has the molecular formula C15H30O4Si and a molecular weight of 302.49 g/mol. Its IUPAC name is tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate.

Molecular Properties

Compound Nametert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate
PubChem CID59981766
Molecular FormulaC15H30O4Si
Molecular Weight302.49 g/mol
Exact Mass302.19
IUPAC Nametert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate
SMILESC=C(COC(=O)OC(C)(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H30O4Si/c1-12(10-17-13(16)19-14(2,3)4)11-18-20(8,9)15(5,6)7/h1,10-11H2,2-9H3
InChIKeyWVOLHBDOTNTQBE-UHFFFAOYSA-N
XLogP4.52
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.49
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate?
The IUPAC name of tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate (CID 59981766) is tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate.
What is the SMILES notation for tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate?
The canonical SMILES for tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate is C=C(COC(=O)OC(C)(C)C)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate?
The InChIKey is WVOLHBDOTNTQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O4Si/c1-12(10-17-13(16)19-14(2,3)4)11-18-20(8,9)15(5,6)7/h1,10-11H2,2-9H3.
What are the key properties of tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate?
tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate has a molecular weight of 302.49 g/mol, XLogP of 4.52, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate is sourced from PubChem (CID 59981766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).