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

C17H36OSi2 — CID 134919782

IUPAC2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone
SMILESCCC[Si](CCC)(CCC)C(=C=O)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36OSi2/c1-9-12-20(13-10-2,14-11-3)16(15-18)19(7,8)17(4,5)6/h9-14H2,1-8H3
InChIKeyNORFRASCSIAOBV-UHFFFAOYSA-N
MW312.65 g/mol
LogP6.01
Rot. Bonds8

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

2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone (PubChem CID 134919782) has the molecular formula C17H36OSi2 and a molecular weight of 312.65 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone
PubChem CID134919782
Molecular FormulaC17H36OSi2
Molecular Weight312.65 g/mol
Exact Mass312.23
IUPAC Name2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone
SMILESCCC[Si](CCC)(CCC)C(=C=O)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36OSi2/c1-9-12-20(13-10-2,14-11-3)16(15-18)19(7,8)17(4,5)6/h9-14H2,1-8H3
InChIKeyNORFRASCSIAOBV-UHFFFAOYSA-N
XLogP6.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.65
LogP ≤ 56.01
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-tributylsilylethenone
CID 134919366
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-tripropylsilylethenone?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone (CID 134919782) is 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone is CCC[Si](CCC)(CCC)C(=C=O)[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone?
The InChIKey is NORFRASCSIAOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36OSi2/c1-9-12-20(13-10-2,14-11-3)16(15-18)19(7,8)17(4,5)6/h9-14H2,1-8H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone?
2-[tert-butyl(dimethyl)silyl]-2-tripropylsilylethenone has a molecular weight of 312.65 g/mol, XLogP of 6.01, 8 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-tripropylsilylethenone is sourced from PubChem (CID 134919782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).