methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate

C13H26O4Si — CID 139253695

IUPACmethyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate
SMILESCC[Si](CC)(CC)OCC/C=C/COC(=O)OC
InChIInChI=1S/C13H26O4Si/c1-5-18(6-2,7-3)17-12-10-8-9-11-16-13(14)15-4/h8-9H,5-7,10-12H2,1-4H3/b9-8+
InChIKeyZENXOEMHAHXSGJ-CMDGGOBGSA-N
MW274.43 g/mol
LogP3.74
Rot. Bonds9

About methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate

methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate (PubChem CID 139253695) has the molecular formula C13H26O4Si and a molecular weight of 274.43 g/mol. Its IUPAC name is methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate.

Molecular Properties

Compound Namemethyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate
PubChem CID139253695
Molecular FormulaC13H26O4Si
Molecular Weight274.43 g/mol
Exact Mass274.16
IUPAC Namemethyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate
SMILESCC[Si](CC)(CC)OCC/C=C/COC(=O)OC
InChIInChI=1S/C13H26O4Si/c1-5-18(6-2,7-3)17-12-10-8-9-11-16-13(14)15-4/h8-9H,5-7,10-12H2,1-4H3/b9-8+
InChIKeyZENXOEMHAHXSGJ-CMDGGOBGSA-N
XLogP3.74
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[(E,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-enyl] methyl carbonate
CID 15326321
[(Z)-6-[tert-butyl(dimethyl)silyl]oxyhex-2-enyl] methyl carbonate
CID 24754552
[(E)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl] methyl carbonate
CID 45139529
[(E)-5-[tert-butyl(dimethyl)silyl]oxypent-2-enyl] methyl carbonate
CID 46702477
methyl [(Z)-4-triethylsilyloxybut-2-enyl] carbonate
CID 101808141
(2E,4Z)-4-((tert-butyldimethylsilyl)oxy)nona-2,4,8-trien-1-yl methyl carbonate
CID 134813865
methyl [(Z)-4-tri(propan-2-yl)silyloxybut-2-enyl] carbonate
CID 139253707
[(Z)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl] ethyl carbonate
CID 11129509
methyl [(Z)-4-trimethylsilylbut-2-enyl] carbonate
CID 59558915
Methyl 4-trimethylsilylbut-2-enyl carbonate
CID 72326228
Methyl 5-propoxypent-2-enyl carbonate
CID 123841485
[(Z)-5,5-dimethoxypent-3-enoxy]-trimethylsilane
CID 140932673

Frequently Asked Questions

What is the IUPAC name of methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate?
The IUPAC name of methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate (CID 139253695) is methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate.
What is the SMILES notation for methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate?
The canonical SMILES for methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate is CC[Si](CC)(CC)OCC/C=C/COC(=O)OC.
What is the InChIKey of methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate?
The InChIKey is ZENXOEMHAHXSGJ-CMDGGOBGSA-N. The full InChI is InChI=1S/C13H26O4Si/c1-5-18(6-2,7-3)17-12-10-8-9-11-16-13(14)15-4/h8-9H,5-7,10-12H2,1-4H3/b9-8+.
What are the key properties of methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate?
methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate has a molecular weight of 274.43 g/mol, XLogP of 3.74, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl [(E)-5-triethylsilyloxypent-2-enyl] carbonate is sourced from PubChem (CID 139253695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).