2-ethoxy-1-silylundecan-1-one

C13H28O2Si — CID 174059863

IUPAC2-ethoxy-1-silylundecan-1-one
SMILESCCCCCCCCCC(OCC)C(=O)[SiH3]
InChIInChI=1S/C13H28O2Si/c1-3-5-6-7-8-9-10-11-12(13(14)16)15-4-2/h12H,3-11H2,1-2,16H3
InChIKeySLIKOTINZVHPJJ-UHFFFAOYSA-N
MW244.45 g/mol
LogP2.42
Rot. Bonds11

About 2-ethoxy-1-silylundecan-1-one

2-ethoxy-1-silylundecan-1-one (PubChem CID 174059863) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is 2-ethoxy-1-silylundecan-1-one.

Molecular Properties

Compound Name2-ethoxy-1-silylundecan-1-one
PubChem CID174059863
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name2-ethoxy-1-silylundecan-1-one
SMILESCCCCCCCCCC(OCC)C(=O)[SiH3]
InChIInChI=1S/C13H28O2Si/c1-3-5-6-7-8-9-10-11-12(13(14)16)15-4-2/h12H,3-11H2,1-2,16H3
InChIKeySLIKOTINZVHPJJ-UHFFFAOYSA-N
XLogP2.42
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-ethoxyicosanoic acid
CID 86106777
3-ethoxyundecan-2-one
CID 10262699
2-ethoxyoctanamide
CID 174492663
4-ethoxyoctan-3-one
CID 83226323
cerium(3+);tris(2-ethoxyhexanoate)
CID 22559432
ethyl (2S)-2-hydroxytetracosanoate
CID 98049873
2-decoxydecanoic acid
CID 152638766
2-methoxyhexadecanoic acid
CID 656825
2-methoxytetracosanoic acid
CID 10453501
2-methoxypentacosanoic acid
CID 10476799
4-ethoxytridecan-2-one
CID 89225856
9-ethoxyoctadecane
CID 87148376

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-silylundecan-1-one?
The IUPAC name of 2-ethoxy-1-silylundecan-1-one (CID 174059863) is 2-ethoxy-1-silylundecan-1-one.
What is the SMILES notation for 2-ethoxy-1-silylundecan-1-one?
The canonical SMILES for 2-ethoxy-1-silylundecan-1-one is CCCCCCCCCC(OCC)C(=O)[SiH3].
What is the InChIKey of 2-ethoxy-1-silylundecan-1-one?
The InChIKey is SLIKOTINZVHPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-3-5-6-7-8-9-10-11-12(13(14)16)15-4-2/h12H,3-11H2,1-2,16H3.
What are the key properties of 2-ethoxy-1-silylundecan-1-one?
2-ethoxy-1-silylundecan-1-one has a molecular weight of 244.45 g/mol, XLogP of 2.42, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-silylundecan-1-one is sourced from PubChem (CID 174059863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).