chempirical

Disodium sebacate

C10H16Na2O4CAS 17265-14-4246.21 g/mol

Open in Covalent MOL file
O−OO−ONa+Na+
Carboxylic acid

Properties

Molecular formula
C10H16Na2O4
Molar mass
246.21 g/mol
Exact mass
246.0844 Da
logP
1.51Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
9

Identifiers

CAS number
17265-14-4
SMILES
[O-]C(=O)CCCCCCCCC([O-])=O.[Na+].[Na+]
InChIKey
QFKPJTUVZHVHRZ-UHFFFAOYSA-N
InChI
InChI=1S/C10H18O4.2Na/c11-9(12)7-5-3-1-2-4-6-8-10(13)14;;/h1-8H2,(H,11,12)(H,13,14);;

Weigh it out

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

Names and synonyms

7 names
  • Decanedioic acid, sodium salt (1:2)
  • Sebacic acid, disodium salt
  • Decanedioic acid, disodium salt
  • Sodium sebacate
  • Disodium decanedioate
  • SA-NA
  • NS 18

Work with Disodium sebacate

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

Sodium caprate1002-62-675 % similar Sodium octanoate1984-06-175 % similar Sodium palmitate408-35-575 % similar Sodium laurate629-25-475 % similar Sodium myristate822-12-875 % similar Sodium stearate822-16-275 % similar Disodium succinate150-90-374 % similar Sodium hexanoate10051-44-271 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook