chempirical

Bismuth neodecanoate

C30H57BiO6CAS 34364-26-6722.76 g/mol

Open in Covalent MOL file
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Properties

Molecular formula
C30H57BiO6
Molar mass
722.76 g/mol
Exact mass
722.3959 Da
logP
8.59Crippen estimate
Polar surface area
78.9 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
21

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
34364-26-6
SMILES
CCCCCCC(C)(C)C(=O)O[Bi](OC(=O)C(C)(C)CCCCCC)OC(=O)C(C)(C)CCCCCC
InChIKey
TUQRJVHQQXIPMN-UHFFFAOYSA-K
InChI
InChI=1S/3C10H20O2.Bi/c3*1-4-5-6-7-8-10(2,3)9(11)12;/h3*4-8H2,1-3H3,(H,11,12);/q;;;+3/p-3

Weigh it out

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Names and synonyms

10 names
  • Bismuth trineodecanoate
  • Neodecanoic acid, bismuth(3+) salt (3:1)
  • Neodecanoic acid, bismuth(3+) salt
  • Neodecanoic acid bismuth salt
  • Coscat 83
  • NeoBi 200
  • NeoBi 200BA
  • Valikat bi 2810
  • Bismuth(III) neodecanoate
  • BK 850

Work with Bismuth neodecanoate

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

Vinyl neodecanoate51000-52-362 % similar Glycidyl neodecanoate26761-45-561 % similar 2,2-Dimethylnonanoic acid14250-75-054 % similar Ethyl-2,2-dimethyl-7-bromoheptanoate123469-92-148 % similar 1,15-Diethyl 2,2,14,14-tetramethyl-8-oxopentadecanedioate738606-43-448 % similar 5-Hexyldihydro-5-methyl-2(3H)-furanone7011-83-846 % similar 2,2-Dimethylhexanoic acid813-72-944 % similar 2-Methylpropyl 5-chloro-2,2-dimethylpentanoate109232-37-340 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook