6-trimethylsilyloxydecan-5-one

C13H28O2Si — CID 101053254

IUPAC6-trimethylsilyloxydecan-5-one
SMILESCCCCC(=O)C(CCCC)O[Si](C)(C)C
InChIInChI=1S/C13H28O2Si/c1-6-8-10-12(14)13(11-9-7-2)15-16(3,4)5/h13H,6-11H2,1-5H3
InChIKeyBRBFWVNYOYITSJ-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.16
Rot. Bonds9

About 6-trimethylsilyloxydecan-5-one

6-trimethylsilyloxydecan-5-one (PubChem CID 101053254) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is 6-trimethylsilyloxydecan-5-one.

Molecular Properties

Compound Name6-trimethylsilyloxydecan-5-one
PubChem CID101053254
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name6-trimethylsilyloxydecan-5-one
SMILESCCCCC(=O)C(CCCC)O[Si](C)(C)C
InChIInChI=1S/C13H28O2Si/c1-6-8-10-12(14)13(11-9-7-2)15-16(3,4)5/h13H,6-11H2,1-5H3
InChIKeyBRBFWVNYOYITSJ-UHFFFAOYSA-N
XLogP4.16
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-trimethylsilyloxyhexadecanoate
CID 524469
trimethylsilyl 2-trimethylsilyloxyoctanoate
CID 91730031
5-methoxynonan-4-one
CID 83225262
decan-5-yloxy(trimethyl)silane
CID 553210
4-propylnonan-5-one
CID 19931333
4-methoxypentadecan-5-one
CID 116708152
butyl 2-trimethylsilyloxypropanoate
CID 88549339
(4S)-4-methylnonan-5-one;(4R)-4-methylnonan-5-one
CID 162100012
2-trimethylsilyloxybutanoic acid
CID 88616813
4-ethoxyoctan-3-one
CID 83226323
2-bromooxyheptanoic acid
CID 151321599
methyl 12-trimethylsilyloxyoctadecanoate
CID 604384

Frequently Asked Questions

What is the IUPAC name of 6-trimethylsilyloxydecan-5-one?
The IUPAC name of 6-trimethylsilyloxydecan-5-one (CID 101053254) is 6-trimethylsilyloxydecan-5-one.
What is the SMILES notation for 6-trimethylsilyloxydecan-5-one?
The canonical SMILES for 6-trimethylsilyloxydecan-5-one is CCCCC(=O)C(CCCC)O[Si](C)(C)C.
What is the InChIKey of 6-trimethylsilyloxydecan-5-one?
The InChIKey is BRBFWVNYOYITSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-6-8-10-12(14)13(11-9-7-2)15-16(3,4)5/h13H,6-11H2,1-5H3.
What are the key properties of 6-trimethylsilyloxydecan-5-one?
6-trimethylsilyloxydecan-5-one has a molecular weight of 244.45 g/mol, XLogP of 4.16, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-trimethylsilyloxydecan-5-one is sourced from PubChem (CID 101053254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).