triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane

C10H18F6O3Si — CID 19963852

IUPACtriethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane
SMILESCCO[Si](CC(C(F)(F)F)C(F)(F)F)(OCC)OCC
InChIInChI=1S/C10H18F6O3Si/c1-4-17-20(18-5-2,19-6-3)7-8(9(11,12)13)10(14,15)16/h8H,4-7H2,1-3H3
InChIKeySJQNLKQIEGNTMW-UHFFFAOYSA-N
MW328.33 g/mol
LogP3.78
Rot. Bonds8

About triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane

triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane (PubChem CID 19963852) has the molecular formula C10H18F6O3Si and a molecular weight of 328.33 g/mol. Its IUPAC name is triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane.

Molecular Properties

Compound Nametriethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane
PubChem CID19963852
Molecular FormulaC10H18F6O3Si
Molecular Weight328.33 g/mol
Exact Mass328.09
IUPAC Nametriethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane
SMILESCCO[Si](CC(C(F)(F)F)C(F)(F)F)(OCC)OCC
InChIInChI=1S/C10H18F6O3Si/c1-4-17-20(18-5-2,19-6-3)7-8(9(11,12)13)10(14,15)16/h8H,4-7H2,1-3H3
InChIKeySJQNLKQIEGNTMW-UHFFFAOYSA-N
XLogP3.78
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.33
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane?
The IUPAC name of triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane (CID 19963852) is triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane.
What is the SMILES notation for triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane?
The canonical SMILES for triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane is CCO[Si](CC(C(F)(F)F)C(F)(F)F)(OCC)OCC.
What is the InChIKey of triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane?
The InChIKey is SJQNLKQIEGNTMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F6O3Si/c1-4-17-20(18-5-2,19-6-3)7-8(9(11,12)13)10(14,15)16/h8H,4-7H2,1-3H3.
What are the key properties of triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane?
triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane has a molecular weight of 328.33 g/mol, XLogP of 3.78, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[3,3,3-trifluoro-2-(trifluoromethyl)propyl]silane is sourced from PubChem (CID 19963852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).