Benzoic acid, 4-(trans-4-pentylcyclohexyl)-, (1R)-1-phenyl-1,2-ethanediyl ester

Catalog Number

154102-21-3

CAS

154102-21-3

IUPAC Name

[(2R)-2-[4-(4-pentylcyclohexyl)benzoyl]oxy-2-phenylethyl] 4-(4-pentylcyclohexyl)benzoate

Molecular Weight

650.93

Molecular Formula

C44H58O4

Product Information

Purity

>98.0%

MDL

MFCD26961137

Physical State

Solid

Appearance

White to Almost white powder to crystal

Storage

Sealed in dry. Room temperature.

Melting Point

130-134 °C

Safety Information

Signal Word

Warning

Precautionary Statement

P261-P305+P351+P338

Hazard Statements

H302-H315-H319-H335

Canonical SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OCC(C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)C5CCC(CC5)CCCCC

InChI

InChI=1S/C44H58O4/c1-3-5-8-12-33-16-20-35(21-17-33)37-24-28-40(29-25-37)43(45)47-32-42(39-14-10-7-11-15-39)48-44(46)41-30-26-38(27-31-41)36-22-18-34(19-23-36)13-9-6-4-2/h7,10-11,14-15,24-31,33-36,42H,3-6,8-9,12-13,16-23,32H2,1-2H3/t33?,34?,35?,36?,42-/m0/s1

InChI Key

KTIVHFRVDVVCHK-BAFIUCHISA-N