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

C13H26O4Si — CID 134963956

IUPAC2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate
SMILESC=C(COC(=O)OCC)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O4Si/c1-8-15-12(14)16-9-11(2)10-17-18(6,7)13(3,4)5/h2,8-10H2,1,3-7H3
InChIKeyQPWQYTXZGBDISZ-UHFFFAOYSA-N
MW274.43 g/mol
LogP3.74
Rot. Bonds6

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

2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate (PubChem CID 134963956) has the molecular formula C13H26O4Si and a molecular weight of 274.43 g/mol. Its IUPAC name is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate.

Molecular Properties

Compound Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate
PubChem CID134963956
Molecular FormulaC13H26O4Si
Molecular Weight274.43 g/mol
Exact Mass274.16
IUPAC Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate
SMILESC=C(COC(=O)OCC)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O4Si/c1-8-15-12(14)16-9-11(2)10-17-18(6,7)13(3,4)5/h2,8-10H2,1,3-7H3
InChIKeyQPWQYTXZGBDISZ-UHFFFAOYSA-N
XLogP3.74
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 53.74
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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Related Compounds

Carbonic acid 2-ethoxycarbonyloxymethyl-allyl ester ethyl ester
CID 10922384
methyl [(Z)-3-trimethylsilyl-2-(trimethylsilylmethyl)prop-2-enyl] carbonate
CID 13674051
[(E)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl] methyl carbonate
CID 45139529
Tert-butyl 2-triethoxysilylprop-2-enyl carbonate
CID 45277052
Tert-butyl 2-(trimethylsilylmethyl)buta-2,3-dienyl carbonate
CID 71732672
[(Z)-4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-enyl] methyl carbonate
CID 176426920
[(Z)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl] ethyl carbonate
CID 11129509
methyl [(E)-3-trimethylsilyl-2-(trimethylsilylmethyl)prop-2-enyl] carbonate
CID 102436911
Ethyl 2-trimethylsilylbuta-2,3-dienyl carbonate
CID 20765143
Tert-butyl 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl carbonate
CID 59981766
Tert-butyl [4-[tert-butyl(dimethyl)silyl]oxy-2-[(2-methylpropan-2-yl)oxycarbonyloxymethyl]but-2-enyl] carbonate
CID 89326737
3-[Methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate
CID 139816459

Frequently Asked Questions

What is the IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate?
The IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate (CID 134963956) is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate.
What is the SMILES notation for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate?
The canonical SMILES for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate is C=C(COC(=O)OCC)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate?
The InChIKey is QPWQYTXZGBDISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O4Si/c1-8-15-12(14)16-9-11(2)10-17-18(6,7)13(3,4)5/h2,8-10H2,1,3-7H3.
What are the key properties of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate?
2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate has a molecular weight of 274.43 g/mol, XLogP of 3.74, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]prop-2-enyl ethyl carbonate is sourced from PubChem (CID 134963956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).