ethyl 3-methyl-3-trimethylsilyloxypentanoate

C11H24O3Si — CID 552392

IUPACethyl 3-methyl-3-trimethylsilyloxypentanoate
SMILESCCOC(=O)CC(C)(CC)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si/c1-7-11(3,14-15(4,5)6)9-10(12)13-8-2/h7-9H2,1-6H3
InChIKeyFGZVHXCJVPTHKF-UHFFFAOYSA-N
MW232.40 g/mol
LogP2.96
Rot. Bonds6

About ethyl 3-methyl-3-trimethylsilyloxypentanoate

ethyl 3-methyl-3-trimethylsilyloxypentanoate (PubChem CID 552392) has the molecular formula C11H24O3Si and a molecular weight of 232.40 g/mol. Its IUPAC name is ethyl 3-methyl-3-trimethylsilyloxypentanoate.

Molecular Properties

Compound Nameethyl 3-methyl-3-trimethylsilyloxypentanoate
PubChem CID552392
Molecular FormulaC11H24O3Si
Molecular Weight232.40 g/mol
Exact Mass232.15
IUPAC Nameethyl 3-methyl-3-trimethylsilyloxypentanoate
SMILESCCOC(=O)CC(C)(CC)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si/c1-7-11(3,14-15(4,5)6)9-10(12)13-8-2/h7-9H2,1-6H3
InChIKeyFGZVHXCJVPTHKF-UHFFFAOYSA-N
XLogP2.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethyl 3-methyl-3-trimethylsilyloxypentanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-Dodeoxy-3-C-methylpentonic acid, tris-TMS
CID 523315
Mevalonic lactone, trimethylsilyl
CID 528660
methyl (2R,3R)-2-methyl-3-triethylsilyloxypentanoate
CID 16731925
Mevalonic acid, TMS
CID 91748333
Ethyl 2-ethyl-3-trimethylsilyloxyvalerate
CID 552933
Ethyl 2-methyl-3-trimethylsiloxyvalerate
CID 552954
Ethyl 2-ethyl-3-methyl-3-trimethylsilyloxyvalerate
CID 553006
3-Trimethylsilyloxy-3-methylvaleric acid, trimethylsilyl ester
CID 553013
Pentanoic acid, 3-methyl-3,5-bis[(trimethylsilyl)oxy]-, methyl ester
CID 553345
Butanoic acid, 2-ethyl-3-(triethylsilyloxy)-, ethyl ester
CID 568637
2H-Pyran-2-one, 4-[(tert-butyldimethylsilyl)oxy]tetrahydro-4-methyl-
CID 589237
Pentanoic acid, 4-methyl-3-(t-butyldimethylsilyloxy)-, methyl ester
CID 608938

Frequently Asked Questions

What is the IUPAC name of ethyl 3-methyl-3-trimethylsilyloxypentanoate?
The IUPAC name of ethyl 3-methyl-3-trimethylsilyloxypentanoate (CID 552392) is ethyl 3-methyl-3-trimethylsilyloxypentanoate.
What is the SMILES notation for ethyl 3-methyl-3-trimethylsilyloxypentanoate?
The canonical SMILES for ethyl 3-methyl-3-trimethylsilyloxypentanoate is CCOC(=O)CC(C)(CC)O[Si](C)(C)C.
What is the InChIKey of ethyl 3-methyl-3-trimethylsilyloxypentanoate?
The InChIKey is FGZVHXCJVPTHKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-7-11(3,14-15(4,5)6)9-10(12)13-8-2/h7-9H2,1-6H3.
What are the key properties of ethyl 3-methyl-3-trimethylsilyloxypentanoate?
ethyl 3-methyl-3-trimethylsilyloxypentanoate has a molecular weight of 232.40 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-methyl-3-trimethylsilyloxypentanoate is sourced from PubChem (CID 552392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).