Product Name

  • Name

    4-Propylphenyl-4'-trans-propylcyclohexylcarboxylate

  • EINECS
  • CAS No. 84184-22-5
  • Density 0.984 g/cm3
  • Solubility
  • Melting Point
  • Formula C19H28O2
  • Boiling Point 388.5 °C at 760 mmHg
  • Molecular Weight 287.41648
  • Flash Point 129 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 84184-22-5 (4-Propylphenyl-4'-trans-propylcyclohexylcarboxylate)
  • Hazard Symbols
  • Synonyms 4-Propylphenyl-4-trans-propylcyclohexylcarboxylate;4-Propylphenyl-4-trans-n-propylcyclohexylcarboxylate;4-n-Propylphenyl trans-4-n-propylcyclohexyl-1-carboxylate;trans-4-Propylcyclohexanecarboxylic acid 4-propylphenyl ester
  • PSA 26.30000
  • LogP 5.15100

trans-4-Propylcyclohexanecarboxylic acid 4-propylphenyl ester Specification

The cas register number of trans-4-Propylcyclohexanecarboxylic acid 4-propylphenyl ester is 84184-22-5. It also can be called as 4-n-Propylphenyl trans-4-n-propylcyclohexyl-1-carboxylate and the Systematic name about this chemical is 4-propylphenyl trans-4-propylcyclohexanecarboxylate.

Physical properties about trans-4-Propylcyclohexanecarboxylic acid 4-propylphenyl ester are: (1)ACD/LogP: 6.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.69; (4)ACD/LogD (pH 7.4): 6.69; (5)ACD/BCF (pH 5.5): 71816; (6)ACD/BCF (pH 7.4): 71816; (7)ACD/KOC (pH 5.5): 104151.01; (8)ACD/KOC (pH 7.4): 104151.01; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 26.3Å2; (13)Index of Refraction: 1.503; (14)Molar Refractivity: 86.63 cm3; (15)Molar Volume: 292.9 cm3; (16)Surface Tension: 35.4 dyne/cm; (17)Density: 0.984 g/cm3; (18)Flash Point: 129 °C; (19)Enthalpy of Vaporization: 63.77 kJ/mol; (20)Boiling Point: 388.5 °C at 760 mmHg; (21)Vapour Pressure: 3.06E-06 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: CCC[C@@H]1CC[C@H](CC1)C(=O)Oc2ccc(CCC)cc2
2.InChI: InChI=1/C19H28O2/c1-3-5-15-7-11-17(12-8-15)19(20)21-18-13-9-16(6-4-2)10-14-18/h9-10,13-15,17H,3-8,11-12H2,1-2H3/t15-,17- 
3.InChIKey: RELCEVSGWMRCIZ-JCNLHEQBBG
4.Std. InChI: InChI=1S/C19H28O2/c1-3-5-15-7-11-17(12-8-15)19(20)21-18-13-9-16(6-4-2)10-14-18/h9-10,13-15,17H,3-8,11-12H2,1-2H3/t15-,17-

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