8-trimethylsilyltetradecan-7-one

C17H36OSi — CID 12524696

IUPAC8-trimethylsilyltetradecan-7-one
SMILESCCCCCCC(=O)C(CCCCCC)[Si](C)(C)C
InChIInChI=1S/C17H36OSi/c1-6-8-10-12-14-16(18)17(19(3,4)5)15-13-11-9-7-2/h17H,6-15H2,1-5H3
InChIKeySCOHMCKGQJDKRI-UHFFFAOYSA-N
MW284.56 g/mol
LogP6.20
Rot. Bonds12

About 8-trimethylsilyltetradecan-7-one

8-trimethylsilyltetradecan-7-one (PubChem CID 12524696) has the molecular formula C17H36OSi and a molecular weight of 284.56 g/mol. Its IUPAC name is 8-trimethylsilyltetradecan-7-one.

Molecular Properties

Compound Name8-trimethylsilyltetradecan-7-one
PubChem CID12524696
Molecular FormulaC17H36OSi
Molecular Weight284.56 g/mol
Exact Mass284.25
IUPAC Name8-trimethylsilyltetradecan-7-one
SMILESCCCCCCC(=O)C(CCCCCC)[Si](C)(C)C
InChIInChI=1S/C17H36OSi/c1-6-8-10-12-14-16(18)17(19(3,4)5)15-13-11-9-7-2/h17H,6-15H2,1-5H3
InChIKeySCOHMCKGQJDKRI-UHFFFAOYSA-N
XLogP6.20
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.56
LogP ≤ 56.20
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

2-Heptadecanone
CID 18027
Hexadecan-2-one
CID 29251
16-Hentriacontanone
CID 94741
10-Nonadecanone
CID 10441
9-Heptadecanone
CID 10887
12-Tricosanone
CID 10888
3-Hexadecanone
CID 87789
15-Nonacosanone
CID 75997
Nonacosan-10-one
CID 441490
2-Octadecanone
CID 81844
14-Heptacosanone
CID 10955
7-Pentacosanone
CID 54551687

Frequently Asked Questions

What is the IUPAC name of 8-trimethylsilyltetradecan-7-one?
The IUPAC name of 8-trimethylsilyltetradecan-7-one (CID 12524696) is 8-trimethylsilyltetradecan-7-one.
What is the SMILES notation for 8-trimethylsilyltetradecan-7-one?
The canonical SMILES for 8-trimethylsilyltetradecan-7-one is CCCCCCC(=O)C(CCCCCC)[Si](C)(C)C.
What is the InChIKey of 8-trimethylsilyltetradecan-7-one?
The InChIKey is SCOHMCKGQJDKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36OSi/c1-6-8-10-12-14-16(18)17(19(3,4)5)15-13-11-9-7-2/h17H,6-15H2,1-5H3.
What are the key properties of 8-trimethylsilyltetradecan-7-one?
8-trimethylsilyltetradecan-7-one has a molecular weight of 284.56 g/mol, XLogP of 6.20, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-trimethylsilyltetradecan-7-one is sourced from PubChem (CID 12524696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).