Product Name

  • Name

    2 6-DIOCTADECYL-P-CRESOL

  • EINECS
  • CAS No. 19826-60-9
  • Density 0.878 g/cm3
  • Solubility
  • Melting Point
  • Formula C43H80O
  • Boiling Point 666.275 °C at 760 mmHg
  • Molecular Weight 613.09
  • Flash Point 301.712 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 19826-60-9 (2 6-DIOCTADECYL-P-CRESOL)
  • Hazard Symbols
  • Synonyms p-Cresol,2,6-dioctadecyl- (8CI);2,6-Di(n-octadecyl)-p-cresol;2,6-Dioctadecyl-4-methylphenol;2,6-Dioctadecyl-p-cresol;4-Methyl-2,6-dioctadecylphenol;
  • PSA 20.23000
  • LogP 15.30860

Phenol,4-methyl-2,6-dioctadecyl- Specification

The Phenol,4-methyl-2,6-dioctadecyl-, with the CAS registry number 19826-60-9, is also known as 2,6-Dioctadecyl-4-methylphenol. This chemical's molecular formula is C43H80O and molecular weight is 613.09. What's more, its systematic name is 4-Methyl-2,6-dioctadecylphenol.

Physical properties of Phenol,4-methyl-2,6-dioctadecyl- are: (1)ACD/LogP: 20.26; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 21; (4)ACD/LogD (pH 7.4): 21; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 35; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.486; (14)Molar Refractivity: 200.31 cm3; (15)Molar Volume: 697.989 cm3; (16)Polarizability: 79.409×10-24 cm3; (17)Surface Tension: 34.062 dyne/cm; (18)Density: 0.878 g/cm3; (19)Flash Point: 301.712 °C; (20)Enthalpy of Vaporization: 101.499 kJ/mol; (21)Boiling Point: 666.275 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1c(cc(C)cc1CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC
(2)InChI: InChI=1/C43H80O/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41-38-40(3)39-42(43(41)44)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h38-39,44H,4-37H2,1-3H3
(3)InChIKey: LZAIWKMQABZIDI-UHFFFAOYSA-N

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