propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate

C11H24O3Si — CID 14922737

IUPACpropan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate
SMILESCC(C)OC(=O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O3Si/c1-9(2)14-10(12)8-13-15(6,7)11(3,4)5/h9H,8H2,1-7H3
InChIKeyZODXZFDYAORFJK-UHFFFAOYSA-N
MW232.40 g/mol
LogP2.96
Rot. Bonds4

About propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate

propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate (PubChem CID 14922737) has the molecular formula C11H24O3Si and a molecular weight of 232.40 g/mol. Its IUPAC name is propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate.

Molecular Properties

Compound Namepropan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate
PubChem CID14922737
Molecular FormulaC11H24O3Si
Molecular Weight232.40 g/mol
Exact Mass232.15
IUPAC Namepropan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate
SMILESCC(C)OC(=O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O3Si/c1-9(2)14-10(12)8-13-15(6,7)11(3,4)5/h9H,8H2,1-7H3
InChIKeyZODXZFDYAORFJK-UHFFFAOYSA-N
XLogP2.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
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'}

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Related Compounds

propan-2-yl 5-[tert-butyl(dimethyl)silyl]oxy-4-[[tert-butyl(dimethyl)silyl]oxymethyl]pentanoate
CID 167430533
[tert-butyl(dimethyl)silyl] propan-2-yl carbonate
CID 155712738
(2R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoic acid
CID 87766399
6-bromo-1-[tert-butyl(dimethyl)silyl]oxyheptan-2-one
CID 155600165
methyl (3S)-4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutanoate
CID 11817464
2-[tert-butyl(dimethyl)silyl]oxy-N,N-bis[[tert-butyl(dimethyl)silyl]oxymethyl]acetamide
CID 19851352
(E)-1-[tert-butyl(dimethyl)silyl]oxy-6-(methoxymethoxy)hept-3-ene-2,5-dione
CID 101151250
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
CID 13175134
1-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-3-one
CID 72819705
[(2R,3S)-3-bromo-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl] acetate
CID 23254785
methyl (4S)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylpentanoate
CID 11737070
methyl 5-[tert-butyl(dimethyl)silyl]oxy-3-methylpentanoate
CID 14234520

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate?
The IUPAC name of propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate (CID 14922737) is propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate.
What is the SMILES notation for propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate?
The canonical SMILES for propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate is CC(C)OC(=O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate?
The InChIKey is ZODXZFDYAORFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-9(2)14-10(12)8-13-15(6,7)11(3,4)5/h9H,8H2,1-7H3.
What are the key properties of propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate?
propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate has a molecular weight of 232.40 g/mol, XLogP of 2.96, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate is sourced from PubChem (CID 14922737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).