ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate

C10H13F11O4Si — CID 20577558

IUPACethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate
SMILESCCO[Si](OCC(F)(F)F)(OCC(F)(F)C(F)F)OCC(F)(F)C(F)F
InChIInChI=1S/C10H13F11O4Si/c1-2-22-26(25-5-10(19,20)21,23-3-8(15,16)6(11)12)24-4-9(17,18)7(13)14/h6-7H,2-5H2,1H3
InChIKeyFZVSVFZLFPELAE-UHFFFAOYSA-N
MW434.27 g/mol
LogP3.87
Rot. Bonds12

About ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate

ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate (PubChem CID 20577558) has the molecular formula C10H13F11O4Si and a molecular weight of 434.27 g/mol. Its IUPAC name is ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate.

Molecular Properties

Compound Nameethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate
PubChem CID20577558
Molecular FormulaC10H13F11O4Si
Molecular Weight434.27 g/mol
Exact Mass434.04
IUPAC Nameethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate
SMILESCCO[Si](OCC(F)(F)F)(OCC(F)(F)C(F)F)OCC(F)(F)C(F)F
InChIInChI=1S/C10H13F11O4Si/c1-2-22-26(25-5-10(19,20)21,23-3-8(15,16)6(11)12)24-4-9(17,18)7(13)14/h6-7H,2-5H2,1H3
InChIKeyFZVSVFZLFPELAE-UHFFFAOYSA-N
XLogP3.87
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.27
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

Silicic acid (H4SiO4), tetrakis(2,2,2-trifluoroethyl) ester
CID 10971926
Triethyl 1,1,1,3,3,3-hexafluoropropan-2-yl silicate
CID 11056596
Tetrakis(2,2,3,3-tetrafluoropropyl) silicate
CID 13310506
Diethyl bis(2,2,3,3-tetrafluoropropyl) silicate
CID 20697906
Dimethyl bis(2,2,2-trifluoroethyl) silicate
CID 20697907
Dimethyl bis(2,2,3,3,3-pentafluoropropyl) silicate
CID 20697908
Tetrakis(1,1,2,3,3-pentafluoropropyl) silicate
CID 22112539
Tetrakis[2,3,3,3-tetrafluoro-2-(trifluoromethyl)propyl] silicate
CID 22112540
Triethoxy(1,1,2,2,3,3,3-heptafluoropropyl)silane
CID 22608749
Triethoxy(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)silane
CID 22719450
Triethoxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)silane
CID 23523574
Triethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]silane
CID 23523578

Frequently Asked Questions

What is the IUPAC name of ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate?
The IUPAC name of ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate (CID 20577558) is ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate.
What is the SMILES notation for ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate?
The canonical SMILES for ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate is CCO[Si](OCC(F)(F)F)(OCC(F)(F)C(F)F)OCC(F)(F)C(F)F.
What is the InChIKey of ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate?
The InChIKey is FZVSVFZLFPELAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F11O4Si/c1-2-22-26(25-5-10(19,20)21,23-3-8(15,16)6(11)12)24-4-9(17,18)7(13)14/h6-7H,2-5H2,1H3.
What are the key properties of ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate?
ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate has a molecular weight of 434.27 g/mol, XLogP of 3.87, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl bis(2,2,3,3-tetrafluoropropyl) 2,2,2-trifluoroethyl silicate is sourced from PubChem (CID 20577558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).