Cas no 13784-61-7 (Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl] ester)

Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl] ester structure
13784-61-7 structure
Product Name:Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl] ester
CAS No:13784-61-7
MF:C45H84O8
MW:753.143675804138
CID:179525
PubChem ID:83733
Update Time:2025-04-19

Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl] ester Chemical and Physical Properties

Names and Identifiers

    • Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl] ester
    • [3-decanoyloxy-2,2-bis(decanoyloxymethyl)propyl] decanoate
    • 2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl didecanoate
    • AC1Q632J
    • Decanoic acid, 2,2-bis(((1-oxodecyl)oxy)methyl)-1,3-propanediyl ester
    • Decanoic acid, 2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl ester
    • Pentaerythritol tetracaprate
    • pentaerythritol tetracaproate
    • pentaerythrityl tetracaprate
    • Tetra-O-decanoyl-pentaerythrit
    • Einecs 237-441-5
    • Pentaerythritol tetrakisdecanoate
    • 2,2-Bis[(decanoyloxy)methyl]-1,3-propanediol didecanoate
    • 2,2-Bis[[(1-oxodecyl)oxy]methyl]-1,3-propandiyldidecanoat
    • Decanoic acid, 2,2-bis(1-oxodecyl)oxymethyl-1,3-propanediyl ester
    • Decanoic acid, 1,1'-(2,2-bis(((1-oxodecyl)oxy)methyl)-1,3-propanediyl) ester
    • Decanoic acid, 2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl ester Pentaerythritol tetracaprate decanoic acid,2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl ester
    • 2,2-Bis((decanoyloxy)methyl)propane-1,3-diyl bis(decanoate)
    • 8F4496127K
    • Pentaerythritol, tetrakis(decanoate)
    • Pentaerythritol tetradecanoate
    • DECANOIC ACID, TETRAESTER WITH PENTAERYTHRITOL
    • 2,2-Bis(hydroxymethyl)-propane-1,3-diol tetrasdecanoate
    • 13784-61-7
    • 2,2-Bis(((1-oxodecyl)oxy)methyl)-1,3-propanediyl didecanoate
    • AKOS040753454
    • UNII-8F4496127K
    • DTXSID80864440
    • NS00052901
    • 3-(Decanoyloxy)-2,2-bis[(decanoyloxy)methyl]propyl decanoate #
    • Q27270283
    • SCHEMBL6054778
    • Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl]ester
    • Decanoic acid, neopentanetetrayl ester
    • MXNODNKXIIQMMI-UHFFFAOYSA-N
    • Inchi： 1S/C45H84O8/c1-5-9-13-17-21-25-29-33-41(46)50-37-45(38-51-42(47)34-30-26-22-18-14-10-6-2,39-52-43(48)35-31-27-23-19-15-11-7-3)40-53-44(49)36-32-28-24-20-16-12-8-4/h5-40H2,1-4H3
    • InChI Key： MXNODNKXIIQMMI-UHFFFAOYSA-N
    • SMILES： O(C(CCCCCCCCC)=O)CC(COC(CCCCCCCCC)=O)(COC(CCCCCCCCC)=O)COC(CCCCCCCCC)=O

Computed Properties

  • Exact Mass: 752.617
  • Monoisotopic Mass: 752.617
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 53
  • Rotatable Bond Count: 44
  • Complexity: 731
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 105A^2
  • XLogP3: 16.2

Experimental Properties

  • Density: 0.959
  • Boiling Point: 737.1°Cat760mmHg
  • Flash Point: 283.9°C
  • Refractive Index: 1.466

Decanoic acid,1,1'-[2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl] ester Related Literature

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