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CAS No.: | 115-83-3 |
---|---|
Name: | Pentaerythrityl tetrastearate |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C77H148O8 |
Molecular Weight: | 1202.02 |
Synonyms: | Octadecanoicacid, 2,2-bis[[(1-oxooctadecyl)oxy]methyl]-1,3-propanediyl ester (9CI);Pentaerythritol, tetrastearate (6CI);Stearic acid, neopentanetetrayl ester(8CI);Stearic acid, tetraester with pentaerythritol (7CI);Aflux 54;CyclochemPETS;Deoflow 821;EP 8578;EW 400;EW 440A;Glycolube P;Glycolube P(ETS);H476;Hexawax;Loxial 7119;Loxiol 1206;Loxiol EP 8578;Loxiol HOB 7119;LoxiolP 861;Loxiol VP 861;Loxiol VPG 861;Nissan Electol WEP 6;Nissan Unister H476;Rikester EW 440A;Unister H 476;VPG 861;WEP 6;pentaerythritol stearate; |
EINECS: | 204-110-1 |
Density: | 0.915 g/cm3 |
Melting Point: | 60-66 °C |
Boiling Point: | 998.5 °C at 760 mmHg |
Flash Point: | 342.4 °C |
Appearance: | white beads |
Safety: | 24/25 |
PSA: | 105.20000 |
LogP: | 25.19160 |
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid at 175℃; | |
at 180℃; | |
With trifluoroacetic anhydride | |
With hypophosphorous acid at 80 - 240℃; under 9.75098 Torr; for 34h; Inert atmosphere; Dean-Stark; |
Conditions | Yield |
---|---|
at 100℃; under 2 Torr; |
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Molecule structure of Pentaerythrityl tetrastearate (CAS NO.115-83-3):
IUPAC Name: [3-Octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] octadecanoate
Molecular Weight: 1201.99422 g/mol
Molecular Formula: C77H148O8
Density: 0.915 g/cm3
Melting Point: 60-66 °C
Boiling Point: 998.5 °C at 760 mmHg
Flash Point: 342.4 °C
Index of Refraction: 1.469
Molar Refractivity: 365.84 cm3
Molar Volume: 1313.5 cm3
Surface Tension: 34.7 dyne/cm
Enthalpy of Vaporization: 145.87 kJ/mol
XLogP3-AA: 33.5
H-Bond Acceptor: 8
Rotatable Bond Count: 76
Exact Mass: 1201.117422
MonoIsotopic Mass: 1201.117422
Topological Polar Surface Area: 105
Heavy Atom Count: 85
Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC
InChI: InChI=1S/C77H148O8/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-73(78)82-69-77(70-83-74(79)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,71-84-75(80)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)72-85-76(81)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h5-72H2,1-4H3
InChIKey: OCKWAZCWKSMKNC-UHFFFAOYSA-N
EINECS: 204-110-1
Pentaerythrityl tetrastearate (CAS NO.115-83-3) is an effective lubricant for many polymer compounds in both extrusion and molding processes. It is recommended for use as a mold release agent in polycarbonate, thermoplastic polyesters and other engineering thermoplastics.
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
Pentaerythrityl tetrastearate (CAS NO.115-83-3) is also named as Octadecanoic acid, 1,1'-(2,2-bis(((1-oxooctadecyl)oxy)methyl)-1,3-propanediyl) ester ; Octadecanoic acid, 2,2-bis(((1-oxooctadecyl)oxy)methyl)-1,3-propanediyl ester ; Pentaerythritol tetrastearate . Pentaerythrityl tetrastearate (CAS NO.115-83-3) is white beads. It is soluble in water and common organic solvents.