methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate

C11H20O3Si — CID 10799384

IUPACmethyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate
SMILESCOC(=O)OC1CCC=C1C[Si](C)(C)C
InChIInChI=1S/C11H20O3Si/c1-13-11(12)14-10-7-5-6-9(10)8-15(2,3)4/h6,10H,5,7-8H2,1-4H3
InChIKeyVJTAGGFASOCZOG-UHFFFAOYSA-N
MW228.36 g/mol
LogP3.20
Rot. Bonds3

About methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate

methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate (PubChem CID 10799384) has the molecular formula C11H20O3Si and a molecular weight of 228.36 g/mol. Its IUPAC name is methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate.

Molecular Properties

Compound Namemethyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate
PubChem CID10799384
Molecular FormulaC11H20O3Si
Molecular Weight228.36 g/mol
Exact Mass228.12
IUPAC Namemethyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate
SMILESCOC(=O)OC1CCC=C1C[Si](C)(C)C
InChIInChI=1S/C11H20O3Si/c1-13-11(12)14-10-7-5-6-9(10)8-15(2,3)4/h6,10H,5,7-8H2,1-4H3
InChIKeyVJTAGGFASOCZOG-UHFFFAOYSA-N
XLogP3.20
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate?
The IUPAC name of methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate (CID 10799384) is methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate.
What is the SMILES notation for methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate?
The canonical SMILES for methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate is COC(=O)OC1CCC=C1C[Si](C)(C)C.
What is the InChIKey of methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate?
The InChIKey is VJTAGGFASOCZOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3Si/c1-13-11(12)14-10-7-5-6-9(10)8-15(2,3)4/h6,10H,5,7-8H2,1-4H3.
What are the key properties of methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate?
methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate has a molecular weight of 228.36 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl [2-(trimethylsilylmethyl)cyclopent-2-en-1-yl] carbonate is sourced from PubChem (CID 10799384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).