chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane

C7H10ClF7O2Si — CID 175723768

IUPACchloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane
SMILESCCO[Si](Cl)(OCC)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H10ClF7O2Si/c1-3-16-18(8,17-4-2)7(14,15)5(9,10)6(11,12)13/h3-4H2,1-2H3
InChIKeyGOUJWPICOAUTGB-UHFFFAOYSA-N
MW322.68 g/mol
LogP3.61
Rot. Bonds6

About chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane

chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane (PubChem CID 175723768) has the molecular formula C7H10ClF7O2Si and a molecular weight of 322.68 g/mol. Its IUPAC name is chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane.

Molecular Properties

Compound Namechloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane
PubChem CID175723768
Molecular FormulaC7H10ClF7O2Si
Molecular Weight322.68 g/mol
Exact Mass322.00
IUPAC Namechloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane
SMILESCCO[Si](Cl)(OCC)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H10ClF7O2Si/c1-3-16-18(8,17-4-2)7(14,15)5(9,10)6(11,12)13/h3-4H2,1-2H3
InChIKeyGOUJWPICOAUTGB-UHFFFAOYSA-N
XLogP3.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.68
LogP ≤ 53.61
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-(1,1,2,2,3,3,3-heptafluoropropyl)silane?
The IUPAC name of chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane (CID 175723768) is chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane.
What is the SMILES notation for chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane?
The canonical SMILES for chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane is CCO[Si](Cl)(OCC)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane?
The InChIKey is GOUJWPICOAUTGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClF7O2Si/c1-3-16-18(8,17-4-2)7(14,15)5(9,10)6(11,12)13/h3-4H2,1-2H3.
What are the key properties of chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane?
chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane has a molecular weight of 322.68 g/mol, XLogP of 3.61, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-diethoxy-(1,1,2,2,3,3,3-heptafluoropropyl)silane is sourced from PubChem (CID 175723768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).