dimethyl 2-methyl-2-trimethylsilyloxypentanedioate

C11H22O5Si — CID 11065252

IUPACdimethyl 2-methyl-2-trimethylsilyloxypentanedioate
SMILESCOC(=O)CCC(C)(O[Si](C)(C)C)C(=O)OC
InChIInChI=1S/C11H22O5Si/c1-11(10(13)15-3,16-17(4,5)6)8-7-9(12)14-2/h7-8H2,1-6H3
InChIKeyKALAFLDTTMFZHS-UHFFFAOYSA-N
MW262.38 g/mol
LogP1.72
Rot. Bonds6

About dimethyl 2-methyl-2-trimethylsilyloxypentanedioate

dimethyl 2-methyl-2-trimethylsilyloxypentanedioate (PubChem CID 11065252) has the molecular formula C11H22O5Si and a molecular weight of 262.38 g/mol. Its IUPAC name is dimethyl 2-methyl-2-trimethylsilyloxypentanedioate.

Molecular Properties

Compound Namedimethyl 2-methyl-2-trimethylsilyloxypentanedioate
PubChem CID11065252
Molecular FormulaC11H22O5Si
Molecular Weight262.38 g/mol
Exact Mass262.12
IUPAC Namedimethyl 2-methyl-2-trimethylsilyloxypentanedioate
SMILESCOC(=O)CCC(C)(O[Si](C)(C)C)C(=O)OC
InChIInChI=1S/C11H22O5Si/c1-11(10(13)15-3,16-17(4,5)6)8-7-9(12)14-2/h7-8H2,1-6H3
InChIKeyKALAFLDTTMFZHS-UHFFFAOYSA-N
XLogP1.72
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Pentanedioic acid, 2-[(trimethylsilyl)oxy]-, dimethyl ester
CID 553342
Trimethyl 2-trimethylsilyloxypropane-1,2,3-tricarboxylate
CID 611963
Ethyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methyl-5-oxopentanoate
CID 135066118
2-Furancarboxylic acid, tetrahydro-2-methyl-5-oxo-, trimethylsilyl ester
CID 567315
Pentanedioic acid, 2-methyl-2-[(trimethylsilyl)oxy]-, bis(trimethylsilyl) ester
CID 621459
Diethyl 2-[tert-butyl(dimethyl)silyl]oxypentanedioate
CID 87206553
Dimethyl 2-[dimethyl(2,4,4-trimethylpentan-2-yl)silyl]oxypentanedioate
CID 87206560
1-O-tert-butyl 5-O-methyl 2-[tert-butyl(dimethyl)silyl]oxypentanedioate
CID 91394695
1-O-tert-butyl 5-O-methyl 2,2-bis(methylsilyloxy)pentanedioate
CID 123375883
1-O-tert-butyl 5-O-methyl (2R)-2-[tert-butyl(dimethyl)silyl]oxypentanedioate
CID 164851616
Dimethyl 2-acetyloxy-2-methylpentanedioate
CID 86164720

Frequently Asked Questions

What is the IUPAC name of dimethyl 2-methyl-2-trimethylsilyloxypentanedioate?
The IUPAC name of dimethyl 2-methyl-2-trimethylsilyloxypentanedioate (CID 11065252) is dimethyl 2-methyl-2-trimethylsilyloxypentanedioate.
What is the SMILES notation for dimethyl 2-methyl-2-trimethylsilyloxypentanedioate?
The canonical SMILES for dimethyl 2-methyl-2-trimethylsilyloxypentanedioate is COC(=O)CCC(C)(O[Si](C)(C)C)C(=O)OC.
What is the InChIKey of dimethyl 2-methyl-2-trimethylsilyloxypentanedioate?
The InChIKey is KALAFLDTTMFZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O5Si/c1-11(10(13)15-3,16-17(4,5)6)8-7-9(12)14-2/h7-8H2,1-6H3.
What are the key properties of dimethyl 2-methyl-2-trimethylsilyloxypentanedioate?
dimethyl 2-methyl-2-trimethylsilyloxypentanedioate has a molecular weight of 262.38 g/mol, XLogP of 1.72, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl 2-methyl-2-trimethylsilyloxypentanedioate is sourced from PubChem (CID 11065252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).