dimethoxymethylsilylmethyl 2,2-dimethylpropanoate

C9H20O4Si — CID 150643555

IUPACdimethoxymethylsilylmethyl 2,2-dimethylpropanoate
SMILESCOC(OC)[SiH2]COC(=O)C(C)(C)C
InChIInChI=1S/C9H20O4Si/c1-9(2,3)7(10)13-6-14-8(11-4)12-5/h8H,6,14H2,1-5H3
InChIKeyJAKGLMAHTDHIIA-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.28
Rot. Bonds5

About dimethoxymethylsilylmethyl 2,2-dimethylpropanoate

dimethoxymethylsilylmethyl 2,2-dimethylpropanoate (PubChem CID 150643555) has the molecular formula C9H20O4Si and a molecular weight of 220.34 g/mol. Its IUPAC name is dimethoxymethylsilylmethyl 2,2-dimethylpropanoate.

Molecular Properties

Compound Namedimethoxymethylsilylmethyl 2,2-dimethylpropanoate
PubChem CID150643555
Molecular FormulaC9H20O4Si
Molecular Weight220.34 g/mol
Exact Mass220.11
IUPAC Namedimethoxymethylsilylmethyl 2,2-dimethylpropanoate
SMILESCOC(OC)[SiH2]COC(=O)C(C)(C)C
InChIInChI=1S/C9H20O4Si/c1-9(2,3)7(10)13-6-14-8(11-4)12-5/h8H,6,14H2,1-5H3
InChIKeyJAKGLMAHTDHIIA-UHFFFAOYSA-N
XLogP0.28
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

[3-(2,2-dimethylpropanoyloxy)-2-methylpropyl] 2,2-dimethylpropanoate
CID 59464527
ethyl 2,2-dimethylpropanoate;hydrochloride
CID 141019550
2,3-dichloropropyl 2,2-dimethylpropanoate
CID 102162680
methyl 3-(dimethoxymethylsilyl)-2-methylpropanoate
CID 57354389
[2-(2,2-dimethylpropanoyloxymethyl)-3,3-dimethylbutyl] 2,2-dimethylpropanoate
CID 169049082
dimethoxymethylsilylmethyl 2-methylprop-2-enoate;2-trimethoxysilylethyl 2-methylprop-2-enoate
CID 173132683
(3,3-dimethyl-2-oxobutyl) 2,2-dimethylpropanoate
CID 10035882
(2-hydroxy-2-methylpropyl) 2,2-dimethylpropanoate
CID 10583373
[(2S)-2-amino-3-methylbutyl] 2,2-dimethylpropanoate
CID 89201508
2-methylbutyl 2,2-dimethylpropanoate
CID 20746726
2-aminooxyethyl 2,2-dimethylpropanoate
CID 130209024
3-chlorobutyl 2,2-dimethylpropanoate
CID 11672837

Frequently Asked Questions

What is the IUPAC name of dimethoxymethylsilylmethyl 2,2-dimethylpropanoate?
The IUPAC name of dimethoxymethylsilylmethyl 2,2-dimethylpropanoate (CID 150643555) is dimethoxymethylsilylmethyl 2,2-dimethylpropanoate.
What is the SMILES notation for dimethoxymethylsilylmethyl 2,2-dimethylpropanoate?
The canonical SMILES for dimethoxymethylsilylmethyl 2,2-dimethylpropanoate is COC(OC)[SiH2]COC(=O)C(C)(C)C.
What is the InChIKey of dimethoxymethylsilylmethyl 2,2-dimethylpropanoate?
The InChIKey is JAKGLMAHTDHIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O4Si/c1-9(2,3)7(10)13-6-14-8(11-4)12-5/h8H,6,14H2,1-5H3.
What are the key properties of dimethoxymethylsilylmethyl 2,2-dimethylpropanoate?
dimethoxymethylsilylmethyl 2,2-dimethylpropanoate has a molecular weight of 220.34 g/mol, XLogP of 0.28, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxymethylsilylmethyl 2,2-dimethylpropanoate is sourced from PubChem (CID 150643555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).