trimethyl(1,1,1-trifluorononan-2-yloxy)silane

C12H25F3OSi — CID 86241060

IUPACtrimethyl(1,1,1-trifluorononan-2-yloxy)silane
SMILESCCCCCCCC(O[Si](C)(C)C)C(F)(F)F
InChIInChI=1S/C12H25F3OSi/c1-5-6-7-8-9-10-11(12(13,14)15)16-17(2,3)4/h11H,5-10H2,1-4H3
InChIKeyJEDONCWCCOLAOT-UHFFFAOYSA-N
MW270.41 g/mol
LogP5.13
Rot. Bonds8

About trimethyl(1,1,1-trifluorononan-2-yloxy)silane

trimethyl(1,1,1-trifluorononan-2-yloxy)silane (PubChem CID 86241060) has the molecular formula C12H25F3OSi and a molecular weight of 270.41 g/mol. Its IUPAC name is trimethyl(1,1,1-trifluorononan-2-yloxy)silane.

Molecular Properties

Compound Nametrimethyl(1,1,1-trifluorononan-2-yloxy)silane
PubChem CID86241060
Molecular FormulaC12H25F3OSi
Molecular Weight270.41 g/mol
Exact Mass270.16
IUPAC Nametrimethyl(1,1,1-trifluorononan-2-yloxy)silane
SMILESCCCCCCCC(O[Si](C)(C)C)C(F)(F)F
InChIInChI=1S/C12H25F3OSi/c1-5-6-7-8-9-10-11(12(13,14)15)16-17(2,3)4/h11H,5-10H2,1-4H3
InChIKeyJEDONCWCCOLAOT-UHFFFAOYSA-N
XLogP5.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.41
LogP ≤ 55.13
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'}

Analyze trimethyl(1,1,1-trifluorononan-2-yloxy)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethyl(1,1,1-trifluorononan-2-yloxy)silane?
The IUPAC name of trimethyl(1,1,1-trifluorononan-2-yloxy)silane (CID 86241060) is trimethyl(1,1,1-trifluorononan-2-yloxy)silane.
What is the SMILES notation for trimethyl(1,1,1-trifluorononan-2-yloxy)silane?
The canonical SMILES for trimethyl(1,1,1-trifluorononan-2-yloxy)silane is CCCCCCCC(O[Si](C)(C)C)C(F)(F)F.
What is the InChIKey of trimethyl(1,1,1-trifluorononan-2-yloxy)silane?
The InChIKey is JEDONCWCCOLAOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25F3OSi/c1-5-6-7-8-9-10-11(12(13,14)15)16-17(2,3)4/h11H,5-10H2,1-4H3.
What are the key properties of trimethyl(1,1,1-trifluorononan-2-yloxy)silane?
trimethyl(1,1,1-trifluorononan-2-yloxy)silane has a molecular weight of 270.41 g/mol, XLogP of 5.13, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(1,1,1-trifluorononan-2-yloxy)silane is sourced from PubChem (CID 86241060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).