(2,2,2-trifluoroethyl)hydrazine dihydrochloride

• ChemBase ID: 269030
• Molecular Formular: C2H7Cl2F3N2
• Molecular Mass: 186.9915896
• Monoisotopic Mass: 185.99383825
• SMILES: C(CNN)(F)(F)F.Cl.Cl
• Canonical SMILES: NNCC(F)(F)F.Cl.Cl
• InChI: InChI=1S/C2H5F3N2.2ClH/c3-2(4,5)1-7-6;;/h7H,1,6H2;2*1H
• InChIKey: BFBPEAUWLAFSEH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2,2,2-trifluoroethyl)hydrazine dihydrochloride
• IUPAC Traditional name: (2,2,2-trifluoroethyl)hydrazine dihydrochloride
• Synonyms: (2,2,2-trifluoroethyl)hydrazine dihydrochloride

Database IDs

• MDL Number: MFCD16817475
• PubChem SID: 164324940
• PubChem CID: 50988433

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.12585364
• LogD (pH = 7.4): 0.14027168
• Log P: 0.14498195
• Molar Refractivity: 30.3458 cm^3
• Polarizability: 6.9925127 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.271

Product Information

• Purity: 95%