methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate

C11H20O2Si — CID 13095608

IUPACmethyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate
SMILESCOC(=O)C1CCC([Si](C)(C)C)=C1C
InChIInChI=1S/C11H20O2Si/c1-8-9(11(12)13-2)6-7-10(8)14(3,4)5/h9H,6-7H2,1-5H3
InChIKeySSFSJMHDPMUZHH-UHFFFAOYSA-N
MW212.36 g/mol
LogP2.76
Rot. Bonds2

About methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate

methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate (PubChem CID 13095608) has the molecular formula C11H20O2Si and a molecular weight of 212.36 g/mol. Its IUPAC name is methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate
PubChem CID13095608
Molecular FormulaC11H20O2Si
Molecular Weight212.36 g/mol
Exact Mass212.12
IUPAC Namemethyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate
SMILESCOC(=O)C1CCC([Si](C)(C)C)=C1C
InChIInChI=1S/C11H20O2Si/c1-8-9(11(12)13-2)6-7-10(8)14(3,4)5/h9H,6-7H2,1-5H3
InChIKeySSFSJMHDPMUZHH-UHFFFAOYSA-N
XLogP2.76
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate?
The IUPAC name of methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate (CID 13095608) is methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate.
What is the SMILES notation for methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate?
The canonical SMILES for methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate is COC(=O)C1CCC([Si](C)(C)C)=C1C.
What is the InChIKey of methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate?
The InChIKey is SSFSJMHDPMUZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2Si/c1-8-9(11(12)13-2)6-7-10(8)14(3,4)5/h9H,6-7H2,1-5H3.
What are the key properties of methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate?
methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate has a molecular weight of 212.36 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-3-trimethylsilylcyclopent-2-ene-1-carboxylate is sourced from PubChem (CID 13095608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).