bis(2-fluoroethyl) dimethyl silicate

C6H14F2O4Si — CID 20577556

IUPACbis(2-fluoroethyl) dimethyl silicate
SMILESCO[Si](OC)(OCCF)OCCF
InChIInChI=1S/C6H14F2O4Si/c1-9-13(10-2,11-5-3-7)12-6-4-8/h3-6H2,1-2H3
InChIKeyBJYNLDCHUQCJCG-UHFFFAOYSA-N
MW216.26 g/mol
LogP0.69
Rot. Bonds8

About bis(2-fluoroethyl) dimethyl silicate

bis(2-fluoroethyl) dimethyl silicate (PubChem CID 20577556) has the molecular formula C6H14F2O4Si and a molecular weight of 216.26 g/mol. Its IUPAC name is bis(2-fluoroethyl) dimethyl silicate.

Molecular Properties

Compound Namebis(2-fluoroethyl) dimethyl silicate
PubChem CID20577556
Molecular FormulaC6H14F2O4Si
Molecular Weight216.26 g/mol
Exact Mass216.06
IUPAC Namebis(2-fluoroethyl) dimethyl silicate
SMILESCO[Si](OC)(OCCF)OCCF
InChIInChI=1S/C6H14F2O4Si/c1-9-13(10-2,11-5-3-7)12-6-4-8/h3-6H2,1-2H3
InChIKeyBJYNLDCHUQCJCG-UHFFFAOYSA-N
XLogP0.69
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 bis(2-fluoroethyl) dimethyl silicate?
The IUPAC name of bis(2-fluoroethyl) dimethyl silicate (CID 20577556) is bis(2-fluoroethyl) dimethyl silicate.
What is the SMILES notation for bis(2-fluoroethyl) dimethyl silicate?
The canonical SMILES for bis(2-fluoroethyl) dimethyl silicate is CO[Si](OC)(OCCF)OCCF.
What is the InChIKey of bis(2-fluoroethyl) dimethyl silicate?
The InChIKey is BJYNLDCHUQCJCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14F2O4Si/c1-9-13(10-2,11-5-3-7)12-6-4-8/h3-6H2,1-2H3.
What are the key properties of bis(2-fluoroethyl) dimethyl silicate?
bis(2-fluoroethyl) dimethyl silicate has a molecular weight of 216.26 g/mol, XLogP of 0.69, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-fluoroethyl) dimethyl silicate is sourced from PubChem (CID 20577556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).