2,2,3,3,4,4-Hexafluoro-1,5-pentanediol

• Catalog Number: ACM-MO-376909B
• Product Name: 2,2,3,3,4,4-Hexafluoro-1,5-pentanediol
• CAS: 376-90-9
• Category: Heterocyclic Organic Compound
• Synonyms: 1,5-Dihydroxy-2,2,3,3,4,4-hexafluoropentane
• IUPAC Name: 2,2,3,3,4,4-hexafluoropentane-1,5-diol
• Molecular Weight: 212.09 g/mol
• Molecular Formula: C5H6F6O2
• Canonical SMILES: C(C(C(C(CO)(F)F)(F)F)(F)F)O
• InChI: InChI=1S/C5H6F6O2/c6-3(7,1-12)5(10,11)4(8,9)2-13/h12-13H,1-2H2
• InChI Key: IELVMUPSWDZWSD-UHFFFAOYSA-N
• Boiling Point: 112 °C/10 mmHg
• Melting Point: 79 °C
• Appearance: White to Almost White Powder to Crystal
• Complexity: 162
• Covalently-Bonded Unit Count: 1
• EC Number: 206-819-1
• Exact Mass: 212.027198g/mol
• Formal Charge: 0
• H-Bond Acceptor: 8
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 212.027198g/mol
• NSC Number: 29196
• Physical State: Solid
• Rotatable Bond Count: 4
• UNII: F2KZY84Y8G
• XLogP3: 0.8