4-Propylphenyl (1r,1's,4r,4'S)-4'-propyl-1,1'-bi(cyclohexyl)-4-carboxylate
[CAS# 97564-42-6]

Identification

• Name: 4-Propylphenyl (1r,1's,4r,4'S)-4'-propyl-1,1'-bi(cyclohexyl)-4-carboxylate
• Synonyms: 4-Propylphenyltrans(trans)-4-propyl-1,1-bicyclohexyl-4-carboxylate
• Molecular Formula: C₂₅H₃₈O₂
• Molecular Weight: 370.57
• CAS Registry Number: 97564-42-6
• SMILES: CCCc1ccc(cc1)OC(=O)[C@H]2CC[C@@H](CC2)C3CC[C@@H](CC3)CCC
• InChI: 1S/C25H38O2/c1-3-5-19-7-11-21(12-8-19)22-13-15-23(16-14-22)25(26)27-24-17-9-20(6-4-2)10-18-24/h9-10,17-19,21-23H,3-8,11-16H2,1-2H3/t19-,21?,22-,23-
• InChIKey: JHDGZPSFHYZDNF-IJLMCXJXSA-N

Properties

• Density: 0.993g/cm³ (Cal.)
• Boiling point: 473.862°C at 760 mmHg (Cal.)
• Flash point: 148.001°C (Cal.)