(2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane

C4Cl4F8O — CID 158421583

IUPAC(2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane
SMILESFC(F)(Cl)C(F)(F)OCl.FC(F)(F)C(F)(Cl)Cl
InChIInChI=1S/C2Cl2F4O.C2Cl2F4/c3-1(5,6)2(7,8)9-4;3-1(4,5)2(6,7)8
InChIKeyHAOARLLIMZQKHR-UHFFFAOYSA-N
MW357.84 g/mol
LogP5.23
Rot. Bonds2

About (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane

(2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane (PubChem CID 158421583) has the molecular formula C4Cl4F8O and a molecular weight of 357.84 g/mol. Its IUPAC name is (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane.

Molecular Properties

Compound Name(2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane
PubChem CID158421583
Molecular FormulaC4Cl4F8O
Molecular Weight357.84 g/mol
Exact Mass355.86
IUPAC Name(2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane
SMILESFC(F)(Cl)C(F)(F)OCl.FC(F)(F)C(F)(Cl)Cl
InChIInChI=1S/C2Cl2F4O.C2Cl2F4/c3-1(5,6)2(7,8)9-4;3-1(4,5)2(6,7)8
InChIKeyHAOARLLIMZQKHR-UHFFFAOYSA-N
XLogP5.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.84
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane?
The IUPAC name of (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane (CID 158421583) is (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane.
What is the SMILES notation for (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane?
The canonical SMILES for (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane is FC(F)(Cl)C(F)(F)OCl.FC(F)(F)C(F)(Cl)Cl.
What is the InChIKey of (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane?
The InChIKey is HAOARLLIMZQKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2Cl2F4O.C2Cl2F4/c3-1(5,6)2(7,8)9-4;3-1(4,5)2(6,7)8.
What are the key properties of (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane?
(2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane has a molecular weight of 357.84 g/mol, XLogP of 5.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-1,1,2,2-tetrafluoroethyl) hypochlorite;1,1-dichloro-1,2,2,2-tetrafluoroethane is sourced from PubChem (CID 158421583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).