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Docosanoic acid (3,3,5,5-D4)

Catalog Number ACM1208430538
CAS 1208430-53-8
Synonyms (3,3,5,5-D4)-Docosanoic acid
IUPAC Name 3,3,5,5-tetradeuteriotetracosanoic acid
Molecular Weight 344.61
Molecular Formula C22H40D4O2
InChI InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)/i20D2,22D2
InChI Key QZZGJDVWLFXDLK-CMJIWFEKSA-N
Boiling Point 300 °C (572 °F) at 1013 hPa (760 mmHg)
Melting Point 79-81 °C (174-178 °F)
Purity 95%
Density 0.54 g/cm3 at 25 °C (77 °F)
Appearance White solid
Chemical Formula CH3(CH2)16CD2CH2CD2CH2COOH
Isomeric SMILES [2H]C([2H])(CCCCCCCCCCCCCCCCCCC)CC([2H])([2H])CC(=O)O
Isotopic Enrichment 98 atom % D
pH 5.64 at 1 g/L at 28 °C (82 °F)
Unlabeled CAS 112-85-6
Unlabeled Synonyms Behenic acid
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