(1s,1's,4s,4'R)-4'-Propyl-1,1'-bi(cyclohexyl)-4-yl 4-(trans-4-pentylcyclohexyl)benzoate
[CAS# 947536-74-5]

Identification

• Name: (1s,1's,4s,4'R)-4'-Propyl-1,1'-bi(cyclohexyl)-4-yl 4-(trans-4-pentylcyclohexyl)benzoate
• Synonyms: TRANS,TRANS-4-PROPYLBICYCLOHEXYL-4-YL4-(TRANS-4-PENTYLCYCLOHEXYL)-BENZOATE
• Molecular Formula: C₃₃H₅₂O₂
• Molecular Weight: 480.76
• CAS Registry Number: 947536-74-5
• SMILES: CCCCC[C@H]1CC[C@@H](CC1)C2=CC=C(C=C2)C(=O)O[C@H]3CCC(CC3)[C@H]4CC[C@@H](CC4)CCC
• InChI: 1S/C33H52O2/c1-3-5-6-8-26-11-15-27(16-12-26)29-17-19-31(20-18-29)33(34)35-32-23-21-30(22-24-32)28-13-9-25(7-4-2)10-14-28/h17-20,25-28,30,32H,3-16,21-24H2,1-2H3/t25-,26-,27-,28-,30?,32-
• InChIKey: ILENYPWJXPDJDM-ZJJBIKCLSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 575.7±29.0°C at 760 mmHg (Cal.)
• Flash point: 252.3±10.7°C (Cal.)
• Refractive index: 1.527 (Cal.)