chempirical

Ao 412S

C65H124O8S4CAS 29598-76-31161.94 g/mol

Open in Covalent MOL file
SOOOOSOOSOOS
EsterSulfide

Properties

Molecular formula
C65H124O8S4
Molar mass
1161.94 g/mol
Exact mass
1160.8179 Da
Melting point
48–51 °C
logP
20.32Crippen estimate
Polar surface area
105.2 Ų
H-bond donors / acceptors
0 / 12
Rotatable bonds
64

Identifiers

CAS number
29598-76-3
SMILES
CCCCCCCCCCCCSCCC(=O)OCC(COC(=O)CCSCCCCCCCCCCCC)(COC(=O)CCSCCCCCCCCCCCC)COC(=O)CCSCCCCCCCCCCCC
InChIKey
VSVVZZQIUJXYQA-UHFFFAOYSA-N
InChI
InChI=1S/C65H124O8S4/c1-5-9-13-17-21-25-29-33-37-41-49-74-53-45-61(66)70-57-65(58-71-62(67)46-54-75-50-42-38-34-30-26-22-18-14-10-6-2,59-72-63(68)47-55-76-51-43-39-35-31-27-23-19-15-11-7-3)60-73-64(69)48-56-77-52-44-40-36-32-28-24-20-16-12-8-4/h5-60H2,1-4H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

33 names · show all
  • Propanoic acid, 3-(dodecylthio)-, 1,1′-[2,2-bis[[3-(dodecylthio)-1-oxopropoxy]methyl]-1,3-propanediyl] ester
  • Propionic acid, 3-(dodecylthio)-, neopentanetetrayl ester
  • Propanoic acid, 3-(dodecylthio)-, 2,2-bis[[3-(dodecylthio)-1-oxopropoxy]methyl]-1,3-propanediyl ester
  • Pentaerythritol tetrakis(3-n-dodecylthiopropionate)
  • Pentaerythritol tetrakis[3-(dodecylthio)propionate]
  • Pentaerythritol tetrakis[3-laurylthiopropionate]
  • Pentaerythritol tetrakis(β-laurylthiopropionate)
  • Seenox 412S
  • Pentaerythritol tetrakis(β-dodecylthiopropionate)
  • Pentaerythritol tetrakis(dodecylthiopropionate)
  • Sumilizer TP-D
  • Mark AO 412S
  • ADK Stab AO 412S
  • Tetrakis[methylene-3-(dodecylthio)propionate]methane
  • AO-S 116
  • TP-D
  • Naugard 412S
  • TH 412S
  • Chinox S 4P
  • Antioxidant 412S
  • Pentaerythritol tetra(3-laurylthiopropionate)
  • PTLP
  • Thanox 412S
  • S 4P
  • Adeka AO 412S
  • Pentaerythrithol tetrakis(3-dodecylthiopropionate)
  • ADK Stab AAO 412S
  • Adekastab AO 412S
  • Pentaerythrityl tetrakis(3-laurylthiopropionate)
  • Songnox 4120
  • 2,2-Bis[[3-(dodecylthio)-1-oxopropoxy]methyl]propane-1,3-diyl bis[3-(dodecylthio)propionate]
  • Rianox 412S
  • Antioxidant S 4P

Work with Ao 412S

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Pentaerythrityl tetrastearate115-83-371 % similar Dilauryl thiodipropionate123-28-467 % similar Dimyristyl thiodipropionate16545-54-367 % similar Distearyl thiodipropionate693-36-767 % similar Butyl laurate106-18-351 % similar Butyl myristate110-36-151 % similar Butyl palmitate111-06-851 % similar Butyl stearate123-95-551 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook