chempirical

Cerotic acid

C26H52O2CAS 506-46-7396.70 g/mol

Open in Covalent MOL file
OOH
Carboxylic acid

Properties

Molecular formula
C26H52O2
Molar mass
396.70 g/mol
Exact mass
396.3967 Da
Melting point
88.5 °C
logP
9.45Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
24

Identifiers

CAS number
506-46-7
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChIKey
XMHIUKTWLZUKEX-UHFFFAOYSA-N
InChI
InChI=1S/C26H52O2/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(27)28/h2-25H2,1H3,(H,27,28)

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Names and synonyms

7 names
  • Hexacosanoic acid
  • Cerinic acid
  • Ceratinic acid
  • Ceric acid
  • n-Hexacosanoic acid
  • Cerylic acid
  • NSC 4205

Work with Cerotic acid

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

Pentadecylic acid1002-84-2100 % similar Enanthic acid111-14-8100 % similar Pelargonic acid112-05-0100 % similar Undecylic acid112-37-8100 % similar Behenic acid112-85-6100 % similar Caprylic acid124-07-2100 % similar Lauric acid143-07-7100 % similar Heneicosylic acid2363-71-5100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia