4-Cyanophenyl 4'-Heptyl-4-Biphenylcarboxylate
[CAS# 58573-95-8]

Identification

• Name: 4-Cyanophenyl 4'-Heptyl-4-Biphenylcarboxylate
• Synonyms: 4-Cyanophenyl 4'-heptyl[1,1'-biphenyl]-4-carboxylate #
• Molecular Formula: C₂₇H₂₇NO₂
• Molecular Weight: 397.51
• CAS Registry Number: 58573-95-8
• SMILES: O=C(Oc1ccc(C#N)cc1)c3ccc(c2ccc(cc2)CCCCCCC)cc3
• InChI: 1S/C27H27NO2/c1-2-3-4-5-6-7-21-8-12-23(13-9-21)24-14-16-25(17-15-24)27(29)30-26-18-10-22(20-28)11-19-26/h8-19H,2-7H2,1H3
• InChIKey: ACLRARDQYSCILU-UHFFFAOYSA-N

Properties

• Density: 1.131g/cm³ (Cal.)
• Boiling point: 564.316°C at 760 mmHg (Cal.)
• Flash point: 288.049°C (Cal.)