[2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane

C11H17F7OSi — CID 173414163

IUPAC[2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane
SMILESC[SiH2]C1(CCC(F)(F)C(F)(F)C(F)(F)F)CCCCO1
InChIInChI=1S/C11H17F7OSi/c1-20-8(4-2-3-7-19-8)5-6-9(12,13)10(14,15)11(16,17)18/h2-7,20H2,1H3
InChIKeyRVTFPJYGAHDPME-UHFFFAOYSA-N
MW326.33 g/mol
LogP3.71
Rot. Bonds5

About [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane

[2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane (PubChem CID 173414163) has the molecular formula C11H17F7OSi and a molecular weight of 326.33 g/mol. Its IUPAC name is [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane.

Molecular Properties

Compound Name[2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane
PubChem CID173414163
Molecular FormulaC11H17F7OSi
Molecular Weight326.33 g/mol
Exact Mass326.09
IUPAC Name[2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane
SMILESC[SiH2]C1(CCC(F)(F)C(F)(F)C(F)(F)F)CCCCO1
InChIInChI=1S/C11H17F7OSi/c1-20-8(4-2-3-7-19-8)5-6-9(12,13)10(14,15)11(16,17)18/h2-7,20H2,1H3
InChIKeyRVTFPJYGAHDPME-UHFFFAOYSA-N
XLogP3.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.33
LogP ≤ 53.71
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'}

Analyze [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane with MolForge

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

Launch Full Analysis

Related Compounds

[2-(4,4,4-Trifluorobutyl)oxan-2-yl]silane
CID 123561163
Methyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 123561843
Dimethyl-propyl-[2-(trifluoromethyl)oxan-2-yl]silane
CID 69191346
Trimethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 69887080
Ethenyl-dimethyl-[2-(3,3,3-trifluoropropyl)oxan-2-yl]silane
CID 70260461
[2-(2,2-Difluoropropyl)oxan-2-yl]silane
CID 123356426
Ethenyl-methyl-[2-(4,4,4-trifluorobutyl)oxan-2-yl]silane
CID 123486901
(2-Methyloxan-2-yl)-(3,3,3-trifluoropropyl)silane
CID 123611137
[2-(3,3,3-Trifluoropropyl)oxan-2-yl]silane
CID 123635641
3,3,4,4,5,5,5-Heptafluoropentyl-methyl-(oxan-2-yl)silane
CID 123640939
[2-(3-Fluoropropyl)oxan-2-yl]-dimethylsilane
CID 123882243
Methyl-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-(oxan-2-yl)silane
CID 124009045

Frequently Asked Questions

What is the IUPAC name of [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane?
The IUPAC name of [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane (CID 173414163) is [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane.
What is the SMILES notation for [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane?
The canonical SMILES for [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane is C[SiH2]C1(CCC(F)(F)C(F)(F)C(F)(F)F)CCCCO1.
What is the InChIKey of [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane?
The InChIKey is RVTFPJYGAHDPME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F7OSi/c1-20-8(4-2-3-7-19-8)5-6-9(12,13)10(14,15)11(16,17)18/h2-7,20H2,1H3.
What are the key properties of [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane?
[2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane has a molecular weight of 326.33 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,3,4,4,5,5,5-heptafluoropentyl)oxan-2-yl]-methylsilane is sourced from PubChem (CID 173414163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).