1-bromo-1,1,2,2-tetrafluoroethane

C2BrF4- — CID 140806302

IUPAC1-bromo-1,1,2,2-tetrafluoroethane
SMILESF[C-](F)C(F)(F)Br
InChIInChI=1S/C2BrF4/c3-2(6,7)1(4)5/q-1
InChIKeyIGFYVSAAKGYKKY-UHFFFAOYSA-N
MW179.92 g/mol
LogP2.40
Rot. Bonds1

About 1-bromo-1,1,2,2-tetrafluoroethane

1-bromo-1,1,2,2-tetrafluoroethane (PubChem CID 140806302) has the molecular formula C2BrF4- and a molecular weight of 179.92 g/mol. Its IUPAC name is 1-bromo-1,1,2,2-tetrafluoroethane.

Molecular Properties

Compound Name1-bromo-1,1,2,2-tetrafluoroethane
PubChem CID140806302
Molecular FormulaC2BrF4-
Molecular Weight179.92 g/mol
Exact Mass178.91
IUPAC Name1-bromo-1,1,2,2-tetrafluoroethane
SMILESF[C-](F)C(F)(F)Br
InChIInChI=1S/C2BrF4/c3-2(6,7)1(4)5/q-1
InChIKeyIGFYVSAAKGYKKY-UHFFFAOYSA-N
XLogP2.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.92
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,2-Dibromo-1,1,2,2-tetrafluoroethane
CID 31301
1,1-Dibromo-1,2,2,2-tetrafluoroethane
CID 168688
Bromopentafluoroethane
CID 67719
2-Bromotetrafluoroethylradical
CID 59104676
Magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride
CID 173236126
CID 10241097
CID 10241097

Frequently Asked Questions

What is the IUPAC name of 1-bromo-1,1,2,2-tetrafluoroethane?
The IUPAC name of 1-bromo-1,1,2,2-tetrafluoroethane (CID 140806302) is 1-bromo-1,1,2,2-tetrafluoroethane.
What is the SMILES notation for 1-bromo-1,1,2,2-tetrafluoroethane?
The canonical SMILES for 1-bromo-1,1,2,2-tetrafluoroethane is F[C-](F)C(F)(F)Br.
What is the InChIKey of 1-bromo-1,1,2,2-tetrafluoroethane?
The InChIKey is IGFYVSAAKGYKKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2BrF4/c3-2(6,7)1(4)5/q-1.
What are the key properties of 1-bromo-1,1,2,2-tetrafluoroethane?
1-bromo-1,1,2,2-tetrafluoroethane has a molecular weight of 179.92 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-1,1,2,2-tetrafluoroethane is sourced from PubChem (CID 140806302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).