(1S,1'S,4R,4'R)-4-(3-Buten-1-Yl)-4'-Pentyl-1,1'-Bi(Cyclohexyl)
[CAS# 203864-69-1]

Identification

• Name: (1S,1'S,4R,4'R)-4-(3-Buten-1-Yl)-4'-Pentyl-1,1'-Bi(Cyclohexyl)
• Synonyms: TRANS,TRANS-4-BUT-3-ENYL-4-PENTYL-BICYCLOHEXYL
• Molecular Formula: C₂₁H₃₈
• Molecular Weight: 290.53
• CAS Registry Number: 203864-69-1
• SMILES: CCCCC[C@H]1CC[C@@H](CC1)C2CC[C@@H](CC2)CCC=C
• InChI: 1S/C21H38/c1-3-5-7-9-19-12-16-21(17-13-19)20-14-10-18(11-15-20)8-6-4-2/h4,18-21H,2-3,5-17H2,1H3/t18-,19-,20?,21-
• InChIKey: DTEWNONTMBAKOI-JKTTWMCGSA-N

Properties

• Density: 0.856g/cm³ (Cal.)
• Boiling point: 371.752°C at 760 mmHg (Cal.)
• Flash point: 179.697°C (Cal.)
• Refractive index: 1.471 (Cal.)