chempirical

Dodecylsuccinic anhydride

C16H28O3CAS 2561-85-5268.40 g/mol

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OOO
Acid anhydride

Properties

Molecular formula
C16H28O3
Molar mass
268.40 g/mol
Exact mass
268.2038 Da
Melting point
72–74 °C
logP
4.39Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
11

Identifiers

CAS number
2561-85-5
SMILES
CCCCCCCCCCCCC1CC(=O)OC1=O
InChIKey
YAXXOCZAXKLLCV-UHFFFAOYSA-N
InChI
InChI=1S/C16H28O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15(17)19-16(14)18/h14H,2-13H2,1H3

Weigh it out

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

Names and synonyms

8 names
  • 2,5-Furandione, 3-dodecyldihydro-
  • Succinic anhydride, dodecyl-
  • 3-Dodecyldihydro-2,5-furandione
  • 1,2-Tetradecanedicarboxylic anhydride
  • n-Dodecylsuccinic anhydride
  • Dodecylsuccinic acid anhydride
  • NSC 77128
  • 3-Dodecyloxolane-2,5-dione

Work with Dodecylsuccinic anhydride

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

3-(2-Dodecen-1-yl)dihydro-2,5-furandione19780-11-166 % similar 2-Octenylsuccinic anhydride42482-06-463 % similar Triethoxysilylpropylsuccinic anhydride93642-68-357 % similar γ-Undecalactone104-67-647 % similar ε-Dodecalactone16429-21-347 % similar δ-Tetradecalactone2721-22-447 % similar Gamma-decalactone706-14-947 % similar δ-Undecalactone710-04-347 % similar

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

Elsewhere

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