Basic information
- CAS
15843-91-1- Standard SMILES
CCCCCCCCOc1ccc(C(=O)c2ccccc2)c([O-])c1.CCCCCCCCOc1ccc(C(=O)c2ccccc2)c([O-])c1.[Ni+2]- InChIKey
QNRJQBMXIZKZSP-UHFFFAOYSA-L- Molecular formula
- C42H50NiO6
- Average molar mass
- 709.5 g/mol
- Monoisotopic mass
- 708.296081
Names & identifiers
- Preferred name
- Bis[2-hydroxy-4-(octyloxy)benzophenonato]nickel
- IUPAC
- bis(2-benzoyl-5-octoxyphenolate);nickel(2+)
Names & synonyms
EINECS 239-949-2bis[2-hydroxy-4-(octyloxy)benzophenonato]nickelBis(2-hydroxy-4-(octyloxy)benzophenonato)nickelRefChem:568755239-949-215843-91-1nickel(2+) bis[2-benzoyl-5-(octyloxy)phenolate]DTXSID90935918QNRJQBMXIZKZSP-UHFFFAOYSA-L
Database identifiers
- CAS
15843-91-1- PubChem CID
- 85138
- DTXSID
DTXSID90935918- EC Number
- 239-949-2
Properties
Computed structural properties
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 20
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 349
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationRestricted substance: Bis[2-hydroxy-4-(octyloxy)benzophenonato]nickel
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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