(4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane

C11H17F9OSi — CID 175203408

IUPAC(4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane
SMILESCC(C(F)C(F)(F)C(F)(F)C(F)C(F)C(F)F)C(C)(C)O[SiH3]
InChIInChI=1S/C11H17F9OSi/c1-4(9(2,3)21-22)6(13)10(17,18)11(19,20)7(14)5(12)8(15)16/h4-8H,1-3,22H3
InChIKeyJTMHSQVGOKMBGD-UHFFFAOYSA-N
MW364.32 g/mol
LogP3.25
Rot. Bonds8

About (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane

(4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane (PubChem CID 175203408) has the molecular formula C11H17F9OSi and a molecular weight of 364.32 g/mol. Its IUPAC name is (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane.

Molecular Properties

Compound Name(4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane
PubChem CID175203408
Molecular FormulaC11H17F9OSi
Molecular Weight364.32 g/mol
Exact Mass364.09
IUPAC Name(4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane
SMILESCC(C(F)C(F)(F)C(F)(F)C(F)C(F)C(F)F)C(C)(C)O[SiH3]
InChIInChI=1S/C11H17F9OSi/c1-4(9(2,3)21-22)6(13)10(17,18)11(19,20)7(14)5(12)8(15)16/h4-8H,1-3,22H3
InChIKeyJTMHSQVGOKMBGD-UHFFFAOYSA-N
XLogP3.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.32
LogP ≤ 53.25
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 (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane?
The IUPAC name of (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane (CID 175203408) is (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane.
What is the SMILES notation for (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane?
The canonical SMILES for (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane is CC(C(F)C(F)(F)C(F)(F)C(F)C(F)C(F)F)C(C)(C)O[SiH3].
What is the InChIKey of (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane?
The InChIKey is JTMHSQVGOKMBGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F9OSi/c1-4(9(2,3)21-22)6(13)10(17,18)11(19,20)7(14)5(12)8(15)16/h4-8H,1-3,22H3.
What are the key properties of (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane?
(4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane has a molecular weight of 364.32 g/mol, XLogP of 3.25, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5,5,6,6,7,8,9,9-nonafluoro-2,3-dimethylnonan-2-yl)oxysilane is sourced from PubChem (CID 175203408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).