2,2,2-trifluoroethylhydrazine;dihydrochloride

C2H7Cl2F3N2 — CID 50988433

IUPAC2,2,2-trifluoroethylhydrazine;dihydrochloride
SMILESCl.Cl.NNCC(F)(F)F
InChIInChI=1S/C2H5F3N2.2ClH/c3-2(4,5)1-7-6;;/h7H,1,6H2;2*1H
InChIKeyBFBPEAUWLAFSEH-UHFFFAOYSA-N
MW186.99 g/mol
LogP0.86
Rot. Bonds1

About 2,2,2-trifluoroethylhydrazine;dihydrochloride

2,2,2-trifluoroethylhydrazine;dihydrochloride (PubChem CID 50988433) has the molecular formula C2H7Cl2F3N2 and a molecular weight of 186.99 g/mol. Its IUPAC name is 2,2,2-trifluoroethylhydrazine;dihydrochloride.

Molecular Properties

Compound Name2,2,2-trifluoroethylhydrazine;dihydrochloride
PubChem CID50988433
Molecular FormulaC2H7Cl2F3N2
Molecular Weight186.99 g/mol
Exact Mass185.99
IUPAC Name2,2,2-trifluoroethylhydrazine;dihydrochloride
SMILESCl.Cl.NNCC(F)(F)F
InChIInChI=1S/C2H5F3N2.2ClH/c3-2(4,5)1-7-6;;/h7H,1,6H2;2*1H
InChIKeyBFBPEAUWLAFSEH-UHFFFAOYSA-N
XLogP0.86
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.99
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoroethylhydrazine;dihydrochloride?
The IUPAC name of 2,2,2-trifluoroethylhydrazine;dihydrochloride (CID 50988433) is 2,2,2-trifluoroethylhydrazine;dihydrochloride.
What is the SMILES notation for 2,2,2-trifluoroethylhydrazine;dihydrochloride?
The canonical SMILES for 2,2,2-trifluoroethylhydrazine;dihydrochloride is Cl.Cl.NNCC(F)(F)F.
What is the InChIKey of 2,2,2-trifluoroethylhydrazine;dihydrochloride?
The InChIKey is BFBPEAUWLAFSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5F3N2.2ClH/c3-2(4,5)1-7-6;;/h7H,1,6H2;2*1H.
What are the key properties of 2,2,2-trifluoroethylhydrazine;dihydrochloride?
2,2,2-trifluoroethylhydrazine;dihydrochloride has a molecular weight of 186.99 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoroethylhydrazine;dihydrochloride is sourced from PubChem (CID 50988433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).