BISMUTH(3+) NEODECANOATE

/static/temp/default.svg Search structure
Keyword(s): Food Contact Chemicals ; Plastic additives
Molecule Category Free-form

Structure

InChI Key FNYKAWJEEWSNEH-UHFFFAOYSA-K
Smiles CC(C)(C)CC(C)(C)CC(=O)O[Bi](OC(=O)CC(C)(C)CC(C)(C)C)OC(=O)CC(C)(C)CC(C)(C)C
InChI
InChI=1/3C10H20O2.Bi/c3*1-9(2,3)7-10(4,5)6-8(11)12;/h3*6-7H2,1-5H3,(H,11,12);/q;;;+3/p-3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H20O2.1/3Bi
Molecular Weight 722.4
AlogP 4.39
Hydrogen Bond Acceptor 6.0
Number of Rotational Bond 9.0
Polar Surface Area 120.39
Heavy Atoms 37.0

Cross References

Resources Reference
CAS NUMBER 34364-26-6
NORMAN SUSDAT
CONTENTS