Substance
  • Substance Name: pentaerythritol tetraheptanoate
  • Formula: C33H60O8
  • Molecular Weight: 584.8 g/mol
  • Identifiers:
    • casrn: 25811-35-2
    • pubchemId: 117642
    • iupacname: [3-heptanoyloxy-2,2-bis(heptanoyloxymethyl)propyl] heptanoate
    • inchi: InChI=1S/C33H60O8/c1-5-9-13-17-21-29(34)38-25-33(26-39-30(35)22-18-14-10-6-2,27-40-31(36)23-19-15-11-7-3)28-41-32(37)24-20-16-12-8-4/h5-28H2,1-4H3
    • inchikey: NCGQPNAQUYGWMI-UHFFFAOYSA-N
    • csmiles: CCCCCCC(=O)OCC(COC(=O)CCCCCC)(COC(=O)CCCCCC)COC(=O)CCCCCC
    • ismiles: CCCCCCC(=O)OCC(COC(=O)CCCCCC)(COC(=O)CCCCCC)COC(=O)CCCCCC
    • wikidataId: Q27266319
    • chemspiderId: 105130
    • dsstoxcmpId: DTXCID60102958
    • ecnumber: 247-279-7
pentaerythritol tetraheptanoate
Systems and Datasets