Cas no 89-13-4 (1,2-Benzenedicarboxylicacid, 1-(2-ethylhexyl) 2-(8-methylnonyl) ester)

1,2-Benzenedicarboxylicacid, 1-(2-ethylhexyl) 2-(8-methylnonyl) ester structure
89-13-4 structure
Product Name:1,2-Benzenedicarboxylicacid, 1-(2-ethylhexyl) 2-(8-methylnonyl) ester
CAS No:89-13-4
MF:C26H42O4
MW:418.609288692474
CID:723538
PubChem ID:103767
Update Time:2025-04-19

1,2-Benzenedicarboxylicacid, 1-(2-ethylhexyl) 2-(8-methylnonyl) ester Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzenedicarboxylicacid, 1-(2-ethylhexyl) 2-(8-methylnonyl) ester
    • 2-ethylhexyl 8-methylnonyl phthalate
    • 2-O-(2-ethylhexyl) 1-O-(8-methylnonyl) benzene-1,2-dicarboxylate
    • 1,2-Benzenedicarboxylic acid, 1-(2-ethylhexyl) 2-isodecyl ester
    • EINECS 271-095-6
    • 89-13-4
    • DTXSID70883266
    • 2-Ethylhexyl isodecyl phthalate
    • 53272-22-3
    • NS00041243
    • 1,2-Benzenedicarboxylic acid, 2-ethylhexyl isodecyl ester
    • 1,2-Benzenedicarboxylic acid, 1-(2-ethylhexyl) 2-(8-methylnonyl) ester
    • EINECS 201-883-7
    • Phthalic acid, 2-ethylhexyl 8-methylnonyl ester
    • EINECS 258-455-8
    • SCHEMBL5437739
    • 2-Ethylhexyl isodecyl phthalate(Technical)
    • 1,2-Benzenedicarboxylic acid, 2-ethylhexyl 8-methylnonyl ester
    • Phthalic acid, 2-ethylhexyl isodecyl ester
    • 68515-52-6
    • Inchi: 1S/C26H42O4/c1-5-7-16-22(6-2)20-30-26(28)24-18-13-12-17-23(24)25(27)29-19-14-10-8-9-11-15-21(3)4/h12-13,17-18,21-22H,5-11,14-16,19-20H2,1-4H3
    • InChI Key: KRVAUPJDDLBZBB-UHFFFAOYSA-N
    • SMILES: O(C(C1C=CC=CC=1C(=O)OCCCCCCCC(C)C)=O)CC(CC)CCCC

Computed Properties

  • Exact Mass: 418.30831
  • Monoisotopic Mass: 418.30831
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 18
  • Complexity: 460
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 9
  • Topological Polar Surface Area: 52.6

Experimental Properties

  • Density: 0.973
  • Boiling Point: 405.7°C at 760 mmHg
  • Flash Point: 216.3°C
  • Refractive Index: 1.487
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