1,1,2,2-tetrafluoroethane-1,2-disulfonamide

C2H4F4N2O4S2 — CID 23062174

IUPAC1,1,2,2-tetrafluoroethane-1,2-disulfonamide
SMILESNS(=O)(=O)C(F)(F)C(F)(F)S(N)(=O)=O
InChIInChI=1S/C2H4F4N2O4S2/c3-1(4,13(7,9)10)2(5,6)14(8,11)12/h(H2,7,9,10)(H2,8,11,12)
InChIKeyYABHCCQAUDCDHM-UHFFFAOYSA-N
MW260.19 g/mol
LogP-1.25
Rot. Bonds3

About 1,1,2,2-tetrafluoroethane-1,2-disulfonamide

1,1,2,2-tetrafluoroethane-1,2-disulfonamide (PubChem CID 23062174) has the molecular formula C2H4F4N2O4S2 and a molecular weight of 260.19 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoroethane-1,2-disulfonamide.

Molecular Properties

Compound Name1,1,2,2-tetrafluoroethane-1,2-disulfonamide
PubChem CID23062174
Molecular FormulaC2H4F4N2O4S2
Molecular Weight260.19 g/mol
Exact Mass259.95
IUPAC Name1,1,2,2-tetrafluoroethane-1,2-disulfonamide
SMILESNS(=O)(=O)C(F)(F)C(F)(F)S(N)(=O)=O
InChIInChI=1S/C2H4F4N2O4S2/c3-1(4,13(7,9)10)2(5,6)14(8,11)12/h(H2,7,9,10)(H2,8,11,12)
InChIKeyYABHCCQAUDCDHM-UHFFFAOYSA-N
XLogP-1.25
TPSA120.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.19
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoroethane-1,2-disulfonamide?
The IUPAC name of 1,1,2,2-tetrafluoroethane-1,2-disulfonamide (CID 23062174) is 1,1,2,2-tetrafluoroethane-1,2-disulfonamide.
What is the SMILES notation for 1,1,2,2-tetrafluoroethane-1,2-disulfonamide?
The canonical SMILES for 1,1,2,2-tetrafluoroethane-1,2-disulfonamide is NS(=O)(=O)C(F)(F)C(F)(F)S(N)(=O)=O.
What is the InChIKey of 1,1,2,2-tetrafluoroethane-1,2-disulfonamide?
The InChIKey is YABHCCQAUDCDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4F4N2O4S2/c3-1(4,13(7,9)10)2(5,6)14(8,11)12/h(H2,7,9,10)(H2,8,11,12).
What are the key properties of 1,1,2,2-tetrafluoroethane-1,2-disulfonamide?
1,1,2,2-tetrafluoroethane-1,2-disulfonamide has a molecular weight of 260.19 g/mol, XLogP of -1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoroethane-1,2-disulfonamide is sourced from PubChem (CID 23062174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).