Product Name

  • Name

    bis[(6-methylcyclohex-3-enyl)methyl] adipate

  • EINECS
  • CAS No. 68555-34-0
  • Density 1.009g/cm3
  • Solubility
  • Melting Point
  • Formula C22H34O4
  • Boiling Point 442.9°C at 760 mmHg
  • Molecular Weight 362.56
  • Flash Point 210.8°C
  • Transport Information
  • Appearance
  • Safety Low toxicity by skin contact. When heated to decomposition it emits acrid smoke and irritating vapors.
  • Risk Codes
  • Molecular Structure Molecular Structure of 68555-34-0 (bis[(6-methylcyclohex-3-enyl)methyl] adipate)
  • Hazard Symbols
  • Synonyms Adipic acid,diester with 6-methyl-3-cyclohexene-1-methanol;EINECS 271-425-9;Adipic acid,6-methyl-3-cyclohexenyl-methanol diester;
  • PSA 52.60000
  • LogP 4.83780

Bis((6-methylcyclohex-3-enyl)methyl) adipate Chemical Properties

IUPAC Name: Bis[(6-methylcyclohex-3-en-1-yl)methyl] hexanedioate
Synonyms of Bis((6-methylcyclohex-3-enyl)methyl) adipate (CAS NO.68555-34-0): Adipic acid, 6-methyl-3-cyclohexenyl-methanol diester ; Adipic acid, diester with 6-methyl-3-cyclohexene-1-methanol ; Bis(6-methyl-3-cyclohexenemethyl) adipate ; EINECS 271-425-9 ; Hexanedioic acid, 1,6-bis((6-methyl-3-cyclohexen-1-yl)methyl) ester ; Hexanedioic acid, bis((6-methyl-3-cyclohexen-1-yl)methyl) ester
CAS NO: 68555-34-0 
Molecular Formula of Bis((6-methylcyclohex-3-enyl)methyl) adipate (CAS NO.68555-34-0): C22H34O4
Molecular Weight: 362.503
Molecular Structure:

H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 11
Polar Surface Area: 52.6 Å2
Index of Refraction: 1.483
Molar Refractivity: 102.64 cm3
Molar Volume: 359 cm3
Surface Tension: 37.1 dyne/cm
Density of Bis((6-methylcyclohex-3-enyl)methyl) adipate (CAS NO.68555-34-0): 1.009 g/cm3
Flash Point: 210.8 °C
Enthalpy of Vaporization: 70.04 kJ/mol
Boiling Point: 442.9 °C at 760 mmHg
Vapour Pressure: 4.85E-08 mmHg at 25°C
 

Bis((6-methylcyclohex-3-enyl)methyl) adipate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 16gm/kg (16000mg/kg)   Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974.
rat LD50 oral 8570uL/kg (8.57mL/kg)   Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974.

Bis((6-methylcyclohex-3-enyl)methyl) adipate Consensus Reports

Reported in EPA TSCA Inventory.

Bis((6-methylcyclohex-3-enyl)methyl) adipate Safety Profile

Low toxicity by skin contact. When heated to decomposition it emits acrid smoke and irritating vapors.

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