ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate

C19H42O2Si2 — CID 10760889

IUPACethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate
SMILESCCOC(=O)C([Si](C(C)C)(C(C)C)C(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H42O2Si2/c1-13-21-17(20)18(22(11,12)19(8,9)10)23(14(2)3,15(4)5)16(6)7/h14-16,18H,13H2,1-12H3
InChIKeyOVKOGGWHSAMVRM-UHFFFAOYSA-N
MW358.72 g/mol
LogP6.65
Rot. Bonds7

About ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate

ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate (PubChem CID 10760889) has the molecular formula C19H42O2Si2 and a molecular weight of 358.72 g/mol. Its IUPAC name is ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate.

Molecular Properties

Compound Nameethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate
PubChem CID10760889
Molecular FormulaC19H42O2Si2
Molecular Weight358.72 g/mol
Exact Mass358.27
IUPAC Nameethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate
SMILESCCOC(=O)C([Si](C(C)C)(C(C)C)C(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H42O2Si2/c1-13-21-17(20)18(22(11,12)19(8,9)10)23(14(2)3,15(4)5)16(6)7/h14-16,18H,13H2,1-12H3
InChIKeyOVKOGGWHSAMVRM-UHFFFAOYSA-N
XLogP6.65
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.72
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-[tert-butyl(dimethyl)silyl]-2-triphenylsilylacetate
CID 10790158
ethyl (2R)-2,3,3-trimethylbutanoate
CID 59132263
ethyl (2S,3S)-3-[ditert-butyl(hydroxy)silyl]-2-methylbutanoate
CID 102207719
[(2R)-1-ethoxy-1-oxopropan-2-yl]azanium
CID 6932860
ethyl 2-[2-[2-[tert-butyl(dimethyl)silyl]oxypropanoyloxy]propanoyloxy]propanoate
CID 10177567
ethyl [tert-butyl(dimethyl)silyl]formate
CID 174277744
ethyl 3,3-dimethyl-2-propan-2-ylbutanoate
CID 523552
ethyl (2R,3S)-3-hydroxy-2-methylbutanoate
CID 642623
ethyl 2-fluoro-3-hydroxy-3-methylhexanoate
CID 79366281
ethyl 2-[dimethyl(propan-2-yl)silyl]acetate
CID 102437234
ethyl 2-[tert-butyl(dimethyl)silyl]oxy-5-methyl-2-(3-methylbutyl)hexanoate
CID 134864009
ethyl (E,2R)-4-[tert-butyl(dimethyl)silyl]-2-hydroxybut-3-enoate
CID 125476530

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate?
The IUPAC name of ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate (CID 10760889) is ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate.
What is the SMILES notation for ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate?
The canonical SMILES for ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate is CCOC(=O)C([Si](C(C)C)(C(C)C)C(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate?
The InChIKey is OVKOGGWHSAMVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H42O2Si2/c1-13-21-17(20)18(22(11,12)19(8,9)10)23(14(2)3,15(4)5)16(6)7/h14-16,18H,13H2,1-12H3.
What are the key properties of ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate?
ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate has a molecular weight of 358.72 g/mol, XLogP of 6.65, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[tert-butyl(dimethyl)silyl]-2-tri(propan-2-yl)silylacetate is sourced from PubChem (CID 10760889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).