dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane

C16H28F8O2Si — CID 91694859

IUPACdimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane
SMILESCCCCCCCCCO[Si](C)(C)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C16H28F8O2Si/c1-4-5-6-7-8-9-10-11-25-27(2,3)26-12-14(19,20)16(23,24)15(21,22)13(17)18/h13H,4-12H2,1-3H3
InChIKeyYTMVWKPSUUIRPN-UHFFFAOYSA-N
MW432.47 g/mol
LogP6.64
Rot. Bonds15

About dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane

dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane (PubChem CID 91694859) has the molecular formula C16H28F8O2Si and a molecular weight of 432.47 g/mol. Its IUPAC name is dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane.

Molecular Properties

Compound Namedimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane
PubChem CID91694859
Molecular FormulaC16H28F8O2Si
Molecular Weight432.47 g/mol
Exact Mass432.17
IUPAC Namedimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane
SMILESCCCCCCCCCO[Si](C)(C)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C16H28F8O2Si/c1-4-5-6-7-8-9-10-11-25-27(2,3)26-12-14(19,20)16(23,24)15(21,22)13(17)18/h13H,4-12H2,1-3H3
InChIKeyYTMVWKPSUUIRPN-UHFFFAOYSA-N
XLogP6.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.47
LogP ≤ 56.64
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'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane?
The IUPAC name of dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane (CID 91694859) is dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane.
What is the SMILES notation for dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane?
The canonical SMILES for dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane is CCCCCCCCCO[Si](C)(C)OCC(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane?
The InChIKey is YTMVWKPSUUIRPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28F8O2Si/c1-4-5-6-7-8-9-10-11-25-27(2,3)26-12-14(19,20)16(23,24)15(21,22)13(17)18/h13H,4-12H2,1-3H3.
What are the key properties of dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane?
dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane has a molecular weight of 432.47 g/mol, XLogP of 6.64, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-nonoxy-(2,2,3,3,4,4,5,5-octafluoropentoxy)silane is sourced from PubChem (CID 91694859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).