triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane

C11H22F4O4Si — CID 3024096

IUPACtriethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane
SMILESCCO[Si](CCCOC(F)(F)C(F)F)(OCC)OCC
InChIInChI=1S/C11H22F4O4Si/c1-4-17-20(18-5-2,19-6-3)9-7-8-16-11(14,15)10(12)13/h10H,4-9H2,1-3H3
InChIKeyRPBHMRVPUUGQCM-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.30
Rot. Bonds12

About triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane

triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane (PubChem CID 3024096) has the molecular formula C11H22F4O4Si and a molecular weight of 322.37 g/mol. Its IUPAC name is triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane.

Molecular Properties

Compound Nametriethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane
PubChem CID3024096
Molecular FormulaC11H22F4O4Si
Molecular Weight322.37 g/mol
Exact Mass322.12
IUPAC Nametriethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane
SMILESCCO[Si](CCCOC(F)(F)C(F)F)(OCC)OCC
InChIInChI=1S/C11H22F4O4Si/c1-4-17-20(18-5-2,19-6-3)9-7-8-16-11(14,15)10(12)13/h10H,4-9H2,1-3H3
InChIKeyRPBHMRVPUUGQCM-UHFFFAOYSA-N
XLogP3.30
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
The IUPAC name of triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane (CID 3024096) is triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane.
What is the SMILES notation for triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
The canonical SMILES for triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane is CCO[Si](CCCOC(F)(F)C(F)F)(OCC)OCC.
What is the InChIKey of triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
The InChIKey is RPBHMRVPUUGQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F4O4Si/c1-4-17-20(18-5-2,19-6-3)9-7-8-16-11(14,15)10(12)13/h10H,4-9H2,1-3H3.
What are the key properties of triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane has a molecular weight of 322.37 g/mol, XLogP of 3.30, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[3-(1,1,2,2-tetrafluoroethoxy)propyl]silane is sourced from PubChem (CID 3024096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).