3,4-Bis(Benzylamino)-3-Cyclobutene-1,2-Dione
[CAS# 175204-25-8]

Identification

• Name: 3,4-Bis(Benzylamino)-3-Cyclobutene-1,2-Dione
• Synonyms: 3-CYCLOBUTENE-1,2-DIONE,3,4-BIS[(PHENYLMETHYL)AMINO]-; Cyclobutene-1,2-diol, 3,4-bis(benzylimino)-
• Molecular Formula: C₁₈H₁₆N₂O₂
• Molecular Weight: 292.33
• CAS Registry Number: 175204-25-8
• SMILES: C1=CC=C(C=C1)CNC2=C(C(=O)C2=O)NCC3=CC=CC=C3
• InChI: 1S/C18H16N2O2/c21-17-15(19-11-13-7-3-1-4-8-13)16(18(17)22)20-12-14-9-5-2-6-10-14/h1-10,19-20H,11-12H2
• InChIKey: CDQDQDSGKAKONQ-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 475.8±55.0°C at 760 mmHg (Cal.)
• Flash point: 175.4±31.7°C (Cal.)
• Refractive index: 1.646 (Cal.)

References

• (1): Valeria Amendola, Luigi Fabbrizzi and Lorenzo Mosca. Anion recognition by hydrogen bonding: urea-based receptors, Chem. Soc. Rev., 2010, 39, 3889.