tributoxy(2,3,3-trifluoropropyl)silane

C15H31F3O3Si — CID 87364687

IUPACtributoxy(2,3,3-trifluoropropyl)silane
SMILESCCCCO[Si](CC(F)C(F)F)(OCCCC)OCCCC
InChIInChI=1S/C15H31F3O3Si/c1-4-7-10-19-22(20-11-8-5-2,21-12-9-6-3)13-14(16)15(17)18/h14-15H,4-13H2,1-3H3
InChIKeyPWNRRTRZPJMKKW-UHFFFAOYSA-N
MW344.49 g/mol
LogP4.98
Rot. Bonds15

About tributoxy(2,3,3-trifluoropropyl)silane

tributoxy(2,3,3-trifluoropropyl)silane (PubChem CID 87364687) has the molecular formula C15H31F3O3Si and a molecular weight of 344.49 g/mol. Its IUPAC name is tributoxy(2,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Nametributoxy(2,3,3-trifluoropropyl)silane
PubChem CID87364687
Molecular FormulaC15H31F3O3Si
Molecular Weight344.49 g/mol
Exact Mass344.20
IUPAC Nametributoxy(2,3,3-trifluoropropyl)silane
SMILESCCCCO[Si](CC(F)C(F)F)(OCCCC)OCCCC
InChIInChI=1S/C15H31F3O3Si/c1-4-7-10-19-22(20-11-8-5-2,21-12-9-6-3)13-14(16)15(17)18/h14-15H,4-13H2,1-3H3
InChIKeyPWNRRTRZPJMKKW-UHFFFAOYSA-N
XLogP4.98
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.49
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tributoxy(2,3,3-trifluoropropyl)silane?
The IUPAC name of tributoxy(2,3,3-trifluoropropyl)silane (CID 87364687) is tributoxy(2,3,3-trifluoropropyl)silane.
What is the SMILES notation for tributoxy(2,3,3-trifluoropropyl)silane?
The canonical SMILES for tributoxy(2,3,3-trifluoropropyl)silane is CCCCO[Si](CC(F)C(F)F)(OCCCC)OCCCC.
What is the InChIKey of tributoxy(2,3,3-trifluoropropyl)silane?
The InChIKey is PWNRRTRZPJMKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31F3O3Si/c1-4-7-10-19-22(20-11-8-5-2,21-12-9-6-3)13-14(16)15(17)18/h14-15H,4-13H2,1-3H3.
What are the key properties of tributoxy(2,3,3-trifluoropropyl)silane?
tributoxy(2,3,3-trifluoropropyl)silane has a molecular weight of 344.49 g/mol, XLogP of 4.98, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributoxy(2,3,3-trifluoropropyl)silane is sourced from PubChem (CID 87364687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).