ethyl 2-methyl-3-trimethylsilyloxypentanoate

C11H24O3Si — CID 552954

IUPACethyl 2-methyl-3-trimethylsilyloxypentanoate
SMILESCCOC(=O)C(C)C(CC)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si/c1-7-10(14-15(4,5)6)9(3)11(12)13-8-2/h9-10H,7-8H2,1-6H3
InChIKeyGHXLATCZMBYASA-UHFFFAOYSA-N
MW232.40 g/mol
LogP2.82
Rot. Bonds6

About ethyl 2-methyl-3-trimethylsilyloxypentanoate

ethyl 2-methyl-3-trimethylsilyloxypentanoate (PubChem CID 552954) has the molecular formula C11H24O3Si and a molecular weight of 232.40 g/mol. Its IUPAC name is ethyl 2-methyl-3-trimethylsilyloxypentanoate.

Molecular Properties

Compound Nameethyl 2-methyl-3-trimethylsilyloxypentanoate
PubChem CID552954
Molecular FormulaC11H24O3Si
Molecular Weight232.40 g/mol
Exact Mass232.15
IUPAC Nameethyl 2-methyl-3-trimethylsilyloxypentanoate
SMILESCCOC(=O)C(C)C(CC)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si/c1-7-10(14-15(4,5)6)9(3)11(12)13-8-2/h9-10H,7-8H2,1-6H3
InChIKeyGHXLATCZMBYASA-UHFFFAOYSA-N
XLogP2.82
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 ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Methyl 2-methyl-3-[(trimethylsilyl)oxy]cyclopropane-1-carboxylate
CID 11447018
(2S,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentanoic acid
CID 10868598
ethyl (2R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-methylpentanoate
CID 101906521
Methyl 2,2,4-trimethyl-3-trimethylsiloxyvalerate
CID 14763594
propan-2-yl (3R)-3-[tert-butyl(dimethyl)silyl]oxy-4,4-dimethylpentanoate
CID 58567250
2-Propyl-3-hydroxypentanoic acid, diTMS
CID 523703
Trimethylsilyl 2-methyl-3-[(trimethylsilyl)oxy]pentanoate
CID 528643
2-Methylbutanoic acid, 3-(t-butyldimethylsilyloxy)-, methyl ester
CID 560751
(3R,4S,5S)-4-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethyloxan-2-one
CID 10083872
[(2S,3R)-3-methyl-4-oxohexan-2-yl] (2S,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentanoate
CID 10882872
methyl (2R,3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethyl-5-oxopentanoate
CID 11266221
4-(Propan-2-yl)-3-(trimethylsilyl)oxetan-2-one
CID 12426049

Frequently Asked Questions

What is the IUPAC name of ethyl 2-methyl-3-trimethylsilyloxypentanoate?
The IUPAC name of ethyl 2-methyl-3-trimethylsilyloxypentanoate (CID 552954) is ethyl 2-methyl-3-trimethylsilyloxypentanoate.
What is the SMILES notation for ethyl 2-methyl-3-trimethylsilyloxypentanoate?
The canonical SMILES for ethyl 2-methyl-3-trimethylsilyloxypentanoate is CCOC(=O)C(C)C(CC)O[Si](C)(C)C.
What is the InChIKey of ethyl 2-methyl-3-trimethylsilyloxypentanoate?
The InChIKey is GHXLATCZMBYASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-7-10(14-15(4,5)6)9(3)11(12)13-8-2/h9-10H,7-8H2,1-6H3.
What are the key properties of ethyl 2-methyl-3-trimethylsilyloxypentanoate?
ethyl 2-methyl-3-trimethylsilyloxypentanoate has a molecular weight of 232.40 g/mol, XLogP of 2.82, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-methyl-3-trimethylsilyloxypentanoate is sourced from PubChem (CID 552954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).