methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate

C11H22O5Si — CID 91701873

IUPACmethyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate
SMILESCOC(=O)C(O[Si](C)(C)C)C1COC(C)(C)O1
InChIInChI=1S/C11H22O5Si/c1-11(2)14-7-8(15-11)9(10(12)13-3)16-17(4,5)6/h8-9H,7H2,1-6H3
InChIKeyZZLDEXWJQNDGQG-UHFFFAOYSA-N
MW262.38 g/mol
LogP1.53
Rot. Bonds4

About methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate

methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate (PubChem CID 91701873) has the molecular formula C11H22O5Si and a molecular weight of 262.38 g/mol. Its IUPAC name is methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate.

Molecular Properties

Compound Namemethyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate
PubChem CID91701873
Molecular FormulaC11H22O5Si
Molecular Weight262.38 g/mol
Exact Mass262.12
IUPAC Namemethyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate
SMILESCOC(=O)C(O[Si](C)(C)C)C1COC(C)(C)O1
InChIInChI=1S/C11H22O5Si/c1-11(2)14-7-8(15-11)9(10(12)13-3)16-17(4,5)6/h8-9H,7H2,1-6H3
InChIKeyZZLDEXWJQNDGQG-UHFFFAOYSA-N
XLogP1.53
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 51.53
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

(4R,5R)-Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
CID 774789
Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
CID 615621
Threono-1,4-lactone, bis-TMS
CID 523398
(3R,4R)-3,4-bis(trimethylsilyloxy)oxolan-2-one
CID 6427168
(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
CID 14283028
Dimethyl 2-[(trimethylsilyl)oxy]succinate
CID 552624
diethyl (4R,5R)-2-ethoxy-2-ethyl-1,3-dioxolane-4,5-dicarboxylate
CID 14640162
dipropan-2-yl (4R,5R)-2-methoxy-2-methyl-1,3-dioxolane-4,5-dicarboxylate
CID 14972312
(4R,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
CID 10401143
methyl (4S,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate
CID 14414632
diisopropyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
CID 6712406
Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
CID 496154

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate?
The IUPAC name of methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate (CID 91701873) is methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate.
What is the SMILES notation for methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate?
The canonical SMILES for methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate is COC(=O)C(O[Si](C)(C)C)C1COC(C)(C)O1.
What is the InChIKey of methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate?
The InChIKey is ZZLDEXWJQNDGQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O5Si/c1-11(2)14-7-8(15-11)9(10(12)13-3)16-17(4,5)6/h8-9H,7H2,1-6H3.
What are the key properties of methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate?
methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate has a molecular weight of 262.38 g/mol, XLogP of 1.53, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-trimethylsilyloxyacetate is sourced from PubChem (CID 91701873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).