chempirical

Decanoic anhydride

C20H38O3CAS 2082-76-0326.52 g/mol

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Acid anhydride

Properties

Molecular formula
C20H38O3
Molar mass
326.52 g/mol
Exact mass
326.2821 Da
Density
0.8596 g/mL (at 70 °C)
Melting point
24.7 °C
Boiling point
125–140 °C
logP
6.34Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
16

Identifiers

CAS number
2082-76-0
SMILES
CCCCCCCCCC(=O)OC(=O)CCCCCCCCC
InChIKey
HTWWKYKIBSHDPC-UHFFFAOYSA-N
InChI
InChI=1S/C20H38O3/c1-3-5-7-9-11-13-15-17-19(21)23-20(22)18-16-14-12-10-8-6-4-2/h3-18H2,1-2H3

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Names and synonyms

5 names
  • Decanoic acid, 1,1′-anhydride
  • Decanoic acid, anhydride
  • Capric anhydride
  • Caprinic anhydride
  • Perfluorodecanoic chloride

Work with Decanoic 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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Palmitic anhydride623-65-4100 % similar Heptanoic anhydride626-27-7100 % similar Stearic anhydride638-08-4100 % similar Valeric anhydride2082-59-982 % similar Oleic anhydride24909-72-681 % similar Dilauroyl peroxide105-74-875 % similar Methyl heptanoate106-73-069 % similar Methyl decanoate110-42-969 % similar

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

Same formula

Ethyl (9Z,12R)-12-hydroxy-9-octadecenoate55066-53-0 Polyethylene glycol monooleate9004-96-0

Elsewhere

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