(2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane

C10H11F13OSi — CID 151619344

IUPAC(2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane
SMILESCCC(CO[SiH3])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H11F13OSi/c1-2-4(3-24-25)5(11,12)6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)23/h4H,2-3H2,1,25H3
InChIKeyQOECEHPKRFWPIQ-UHFFFAOYSA-N
MW422.26 g/mol
LogP4.05
Rot. Bonds8

About (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane

(2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane (PubChem CID 151619344) has the molecular formula C10H11F13OSi and a molecular weight of 422.26 g/mol. Its IUPAC name is (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane.

Molecular Properties

Compound Name(2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane
PubChem CID151619344
Molecular FormulaC10H11F13OSi
Molecular Weight422.26 g/mol
Exact Mass422.04
IUPAC Name(2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane
SMILESCCC(CO[SiH3])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H11F13OSi/c1-2-4(3-24-25)5(11,12)6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)23/h4H,2-3H2,1,25H3
InChIKeyQOECEHPKRFWPIQ-UHFFFAOYSA-N
XLogP4.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.26
LogP ≤ 54.05
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-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane?
The IUPAC name of (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane (CID 151619344) is (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane.
What is the SMILES notation for (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane?
The canonical SMILES for (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane is CCC(CO[SiH3])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane?
The InChIKey is QOECEHPKRFWPIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F13OSi/c1-2-4(3-24-25)5(11,12)6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)23/h4H,2-3H2,1,25H3.
What are the key properties of (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane?
(2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane has a molecular weight of 422.26 g/mol, XLogP of 4.05, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)silane is sourced from PubChem (CID 151619344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).