1-[tert-butyl(dimethyl)silyl]nonan-1-one

C15H32OSi — CID 3697443

IUPAC1-[tert-butyl(dimethyl)silyl]nonan-1-one
SMILESCCCCCCCCC(=O)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32OSi/c1-7-8-9-10-11-12-13-14(16)17(5,6)15(2,3)4/h7-13H2,1-6H3
InChIKeyZKGSROOICZFSSS-UHFFFAOYSA-N
MW256.51 g/mol
LogP5.35
Rot. Bonds8

About 1-[tert-butyl(dimethyl)silyl]nonan-1-one

1-[tert-butyl(dimethyl)silyl]nonan-1-one (PubChem CID 3697443) has the molecular formula C15H32OSi and a molecular weight of 256.51 g/mol. Its IUPAC name is 1-[tert-butyl(dimethyl)silyl]nonan-1-one.

Molecular Properties

Compound Name1-[tert-butyl(dimethyl)silyl]nonan-1-one
PubChem CID3697443
Molecular FormulaC15H32OSi
Molecular Weight256.51 g/mol
Exact Mass256.22
IUPAC Name1-[tert-butyl(dimethyl)silyl]nonan-1-one
SMILESCCCCCCCCC(=O)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32OSi/c1-7-8-9-10-11-12-13-14(16)17(5,6)15(2,3)4/h7-13H2,1-6H3
InChIKeyZKGSROOICZFSSS-UHFFFAOYSA-N
XLogP5.35
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.51
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Octyl trimethylsilyl ketone
CID 3538356
Undecanoyl-trimethylsilane
CID 13601208
1-[Tert-butyl(dimethyl)silyl]hexan-1-one
CID 15685380
1-Trimethylsilyldecan-1-one
CID 11790984
1-(Trimethylsilyl)heptan-1-one
CID 12829476
1,1-Dimethylsilacyclotridecan-7-one
CID 554403
1-Triethylsilyloctan-3-one
CID 10332003
1-[Tert-butyl(dimethyl)silyl]octan-1-one
CID 10728899
Silane, tris(1-methylethyl)(1-oxohexyl)-
CID 11076084
Silane, trimethyl(1-oxooctyl)-
CID 11117077
1-Triethylsilylheptan-1-one
CID 11447533
2-[Tert-butyl(dimethyl)silyl]octanal
CID 11831616

Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl(dimethyl)silyl]nonan-1-one?
The IUPAC name of 1-[tert-butyl(dimethyl)silyl]nonan-1-one (CID 3697443) is 1-[tert-butyl(dimethyl)silyl]nonan-1-one.
What is the SMILES notation for 1-[tert-butyl(dimethyl)silyl]nonan-1-one?
The canonical SMILES for 1-[tert-butyl(dimethyl)silyl]nonan-1-one is CCCCCCCCC(=O)[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1-[tert-butyl(dimethyl)silyl]nonan-1-one?
The InChIKey is ZKGSROOICZFSSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32OSi/c1-7-8-9-10-11-12-13-14(16)17(5,6)15(2,3)4/h7-13H2,1-6H3.
What are the key properties of 1-[tert-butyl(dimethyl)silyl]nonan-1-one?
1-[tert-butyl(dimethyl)silyl]nonan-1-one has a molecular weight of 256.51 g/mol, XLogP of 5.35, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butyl(dimethyl)silyl]nonan-1-one is sourced from PubChem (CID 3697443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).