2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal

C16H36O3Si2 — CID 75039555

IUPAC2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal
SMILESCC(C=O)(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H36O3Si2/c1-14(2,3)20(8,9)18-13-16(7,12-17)19-21(10,11)15(4,5)6/h12H,13H2,1-11H3
InChIKeyMTXSENJIPKWRTJ-UHFFFAOYSA-N
MW332.63 g/mol
LogP4.99
Rot. Bonds6

About 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal

2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal (PubChem CID 75039555) has the molecular formula C16H36O3Si2 and a molecular weight of 332.63 g/mol. Its IUPAC name is 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal.

Molecular Properties

Compound Name2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal
PubChem CID75039555
Molecular FormulaC16H36O3Si2
Molecular Weight332.63 g/mol
Exact Mass332.22
IUPAC Name2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal
SMILESCC(C=O)(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H36O3Si2/c1-14(2,3)20(8,9)18-13-16(7,12-17)19-21(10,11)15(4,5)6/h12H,13H2,1-11H3
InChIKeyMTXSENJIPKWRTJ-UHFFFAOYSA-N
XLogP4.99
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.63
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

DL-Glyceraldehyde, 2TBDMS derivative
CID 71337298
(2S)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal
CID 44517038
3-Methyl-3-trimethylsilyloxy-2-tri(propan-2-yl)silylperoxybutanal
CID 101410815
2-[Tert-butyl(dimethyl)silyl]peroxy-3-methyl-3-trimethylsilyloxybutanal
CID 101410816
(2R)-2,3-bis(trimethylsilyloxy)propanal
CID 101662260
(2R)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]propanal
CID 44239380
(2S)-3-ethoxy-2-methyl-2-triethylsilyloxypropanal
CID 58593345
(2S,3R)-3-[tert-butyl(dimethyl)silyl]-2-[[tert-butyl(dimethyl)silyl]oxymethyl]oxirane-2-carbaldehyde
CID 11580763
(2R)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal
CID 72707832
(2R)-3-[tert-butyl(dimethyl)silyl]oxy-2-triethylsilyloxypropanal
CID 101147414
(2S,3R)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]pentanal
CID 101575524
(2R,3S)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]pentanal
CID 101575525

Frequently Asked Questions

What is the IUPAC name of 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal?
The IUPAC name of 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal (CID 75039555) is 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal.
What is the SMILES notation for 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal?
The canonical SMILES for 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal is CC(C=O)(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal?
The InChIKey is MTXSENJIPKWRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O3Si2/c1-14(2,3)20(8,9)18-13-16(7,12-17)19-21(10,11)15(4,5)6/h12H,13H2,1-11H3.
What are the key properties of 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal?
2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal has a molecular weight of 332.63 g/mol, XLogP of 4.99, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpropanal is sourced from PubChem (CID 75039555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).