2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane

C7H11F7OSi — CID 13179202

IUPAC2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane
SMILESC[Si](C)(C)OCC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H11F7OSi/c1-16(2,3)15-4-5(8,9)6(10,11)7(12,13)14/h4H2,1-3H3
InChIKeyGADXKWNKXBHZQQ-UHFFFAOYSA-N
MW272.24 g/mol
LogP3.67
Rot. Bonds4

About 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane

2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane (PubChem CID 13179202) has the molecular formula C7H11F7OSi and a molecular weight of 272.24 g/mol. Its IUPAC name is 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane.

Molecular Properties

Compound Name2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane
PubChem CID13179202
Molecular FormulaC7H11F7OSi
Molecular Weight272.24 g/mol
Exact Mass272.05
IUPAC Name2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane
SMILESC[Si](C)(C)OCC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H11F7OSi/c1-16(2,3)15-4-5(8,9)6(10,11)7(12,13)14/h4H2,1-3H3
InChIKeyGADXKWNKXBHZQQ-UHFFFAOYSA-N
XLogP3.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.24
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane?
The IUPAC name of 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane (CID 13179202) is 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane.
What is the SMILES notation for 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane?
The canonical SMILES for 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane is C[Si](C)(C)OCC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane?
The InChIKey is GADXKWNKXBHZQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F7OSi/c1-16(2,3)15-4-5(8,9)6(10,11)7(12,13)14/h4H2,1-3H3.
What are the key properties of 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane?
2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane has a molecular weight of 272.24 g/mol, XLogP of 3.67, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4,4-heptafluorobutoxy(trimethyl)silane is sourced from PubChem (CID 13179202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).