2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone

C20H42OSi2 — CID 134919366

IUPAC2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone
SMILESCCCC[Si](CCCC)(CCCC)C(=C=O)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi2/c1-9-12-15-23(16-13-10-2,17-14-11-3)19(18-21)22(7,8)20(4,5)6/h9-17H2,1-8H3
InChIKeyAGAKDCAWCBPEMJ-UHFFFAOYSA-N
MW354.73 g/mol
LogP7.18
Rot. Bonds11

About 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone

2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone (PubChem CID 134919366) has the molecular formula C20H42OSi2 and a molecular weight of 354.73 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone
PubChem CID134919366
Molecular FormulaC20H42OSi2
Molecular Weight354.73 g/mol
Exact Mass354.28
IUPAC Name2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone
SMILESCCCC[Si](CCCC)(CCCC)C(=C=O)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi2/c1-9-12-15-23(16-13-10-2,17-14-11-3)19(18-21)22(7,8)20(4,5)6/h9-17H2,1-8H3
InChIKeyAGAKDCAWCBPEMJ-UHFFFAOYSA-N
XLogP7.18
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.73
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(t-Butyldimethylsilyl)trimethylsilylketene
CID 11075174
(Triisopropylsilyl)trimethylsilylketene
CID 15496182
Ethenone, [(1,1-dimethylethyl)dimethylsilyl]-
CID 11768821
2,3-Bis[tert-butyl(dimethyl)silyl]buta-1,3-diene-1,4-dione
CID 14979597
2,2-Bis[tert-butyl(dimethyl)silyl]ethenone
CID 10635781
2-[Tert-butyl(dimethyl)silyl]-2-triethylsilylethenone
CID 10802023
2-[Tert-butyl(dimethyl)silyl]-2-tributylstannylethenone
CID 14920827
Trimethylsilyl tributylstannyl ketene
CID 14959410
2-[Tert-butyl(dimethyl)silyl]-2-[2,3-dimethylbutan-2-yl(dimethyl)silyl]ethenone
CID 101989479
2-[Tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone
CID 134919782
Tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane;ethenone
CID 87069101
2-Methyl-3,3-bis[tri(propan-2-yl)silyl]prop-1-en-1-one
CID 140856616

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone (CID 134919366) is 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone is CCCC[Si](CCCC)(CCCC)C(=C=O)[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone?
The InChIKey is AGAKDCAWCBPEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42OSi2/c1-9-12-15-23(16-13-10-2,17-14-11-3)19(18-21)22(7,8)20(4,5)6/h9-17H2,1-8H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone?
2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone has a molecular weight of 354.73 g/mol, XLogP of 7.18, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]-2-tributylsilylethenone is sourced from PubChem (CID 134919366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).