chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane

C6H10ClF5O2Si — CID 175723734

IUPACchloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane
SMILESCCO[Si](Cl)(OCC)C(F)(F)C(F)(F)F
InChIInChI=1S/C6H10ClF5O2Si/c1-3-13-15(7,14-4-2)6(11,12)5(8,9)10/h3-4H2,1-2H3
InChIKeyABTVXECEFUQAOI-UHFFFAOYSA-N
MW272.67 g/mol
LogP2.97
Rot. Bonds5

About chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane

chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane (PubChem CID 175723734) has the molecular formula C6H10ClF5O2Si and a molecular weight of 272.67 g/mol. Its IUPAC name is chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane.

Molecular Properties

Compound Namechloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane
PubChem CID175723734
Molecular FormulaC6H10ClF5O2Si
Molecular Weight272.67 g/mol
Exact Mass272.01
IUPAC Namechloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane
SMILESCCO[Si](Cl)(OCC)C(F)(F)C(F)(F)F
InChIInChI=1S/C6H10ClF5O2Si/c1-3-13-15(7,14-4-2)6(11,12)5(8,9)10/h3-4H2,1-2H3
InChIKeyABTVXECEFUQAOI-UHFFFAOYSA-N
XLogP2.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.67
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane?
The IUPAC name of chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane (CID 175723734) is chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane.
What is the SMILES notation for chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane?
The canonical SMILES for chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane is CCO[Si](Cl)(OCC)C(F)(F)C(F)(F)F.
What is the InChIKey of chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane?
The InChIKey is ABTVXECEFUQAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10ClF5O2Si/c1-3-13-15(7,14-4-2)6(11,12)5(8,9)10/h3-4H2,1-2H3.
What are the key properties of chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane?
chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane has a molecular weight of 272.67 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-diethoxy-(1,1,2,2,2-pentafluoroethyl)silane is sourced from PubChem (CID 175723734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).