chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane

C7H13ClF4OSi — CID 88684719

IUPACchloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane
SMILESCCC(OC(F)(F)C(F)F)[Si](C)(C)Cl
InChIInChI=1S/C7H13ClF4OSi/c1-4-5(14(2,3)8)13-7(11,12)6(9)10/h5-6H,4H2,1-3H3
InChIKeyVVOZTHZVAPFHAQ-UHFFFAOYSA-N
MW252.71 g/mol
LogP3.62
Rot. Bonds5

About chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane

chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane (PubChem CID 88684719) has the molecular formula C7H13ClF4OSi and a molecular weight of 252.71 g/mol. Its IUPAC name is chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane.

Molecular Properties

Compound Namechloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane
PubChem CID88684719
Molecular FormulaC7H13ClF4OSi
Molecular Weight252.71 g/mol
Exact Mass252.04
IUPAC Namechloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane
SMILESCCC(OC(F)(F)C(F)F)[Si](C)(C)Cl
InChIInChI=1S/C7H13ClF4OSi/c1-4-5(14(2,3)8)13-7(11,12)6(9)10/h5-6H,4H2,1-3H3
InChIKeyVVOZTHZVAPFHAQ-UHFFFAOYSA-N
XLogP3.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.71
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
The IUPAC name of chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane (CID 88684719) is chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane.
What is the SMILES notation for chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
The canonical SMILES for chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane is CCC(OC(F)(F)C(F)F)[Si](C)(C)Cl.
What is the InChIKey of chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
The InChIKey is VVOZTHZVAPFHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13ClF4OSi/c1-4-5(14(2,3)8)13-7(11,12)6(9)10/h5-6H,4H2,1-3H3.
What are the key properties of chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane?
chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane has a molecular weight of 252.71 g/mol, XLogP of 3.62, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane is sourced from PubChem (CID 88684719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).