Titanium, (4-aminobenzoato-kappaO)bis(isooctadecanoato-kappaO)(2-propanolato)-
Basic information
- CAS
68524-91-4- Standard SMILES
CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)O.Nc1ccc(C(=O)O)cc1.[Ti]- InChIKey
ZTBNQOORYFNQJF-UHFFFAOYSA-N- Molecular formula
- C46H87NO7Ti
- Average molar mass
- 814.1 g/mol
- Monoisotopic mass
- 813.5961948
Names & identifiers
- Preferred name
- Titanium, (4-aminobenzoato-kappaO)bis(isooctadecanoato-kappaO)(2-propanolato)-
- IUPAC
- 4-aminobenzoic acid;bis(16-methylheptadecanoic acid);propan-2-ol;titanium
Names & synonyms
EINECS 271-196-5Titanium, (4-aminobenzoato-kappaO)bis(isooctadecanoato-kappaO)(2-propanolato)-RefChem:898371Titanium, (4-aminobenzoato-.kappa.O)bis(isooctadecanoato-.kappa.O)(2-propanolato)-(4-Aminobenzoato-O)bis(isooctadecanoato-O)(propan-2-olato)titanium
Database identifiers
- CAS
68524-91-4- PubChem CID
- 172199
- EC Number
- 271-196-5
Properties
Computed structural properties
- Topological polar surface area
- 158 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 31
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 755
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationTitanium, (4-aminobenzoato-.kappa.O)bis(isooctadecanoato-.kappa.O)(2-propanolato)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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