ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane

C11H15F11OSi — CID 59112362

IUPACethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane
SMILESCCO[Si](C)(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C11H15F11OSi/c1-4-23-24(2,3)6-5-7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h4-6H2,1-3H3
InChIKeyRROYEWVRTGTBNC-UHFFFAOYSA-N
MW400.30 g/mol
LogP5.72
Rot. Bonds8

About ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane

ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane (PubChem CID 59112362) has the molecular formula C11H15F11OSi and a molecular weight of 400.30 g/mol. Its IUPAC name is ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane.

Molecular Properties

Compound Nameethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane
PubChem CID59112362
Molecular FormulaC11H15F11OSi
Molecular Weight400.30 g/mol
Exact Mass400.07
IUPAC Nameethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane
SMILESCCO[Si](C)(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C11H15F11OSi/c1-4-23-24(2,3)6-5-7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h4-6H2,1-3H3
InChIKeyRROYEWVRTGTBNC-UHFFFAOYSA-N
XLogP5.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.30
LogP ≤ 55.72
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 ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane?
The IUPAC name of ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane (CID 59112362) is ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane.
What is the SMILES notation for ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane?
The canonical SMILES for ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane is CCO[Si](C)(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane?
The InChIKey is RROYEWVRTGTBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F11OSi/c1-4-23-24(2,3)6-5-7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h4-6H2,1-3H3.
What are the key properties of ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane?
ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane has a molecular weight of 400.30 g/mol, XLogP of 5.72, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-(3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptyl)silane is sourced from PubChem (CID 59112362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).