Basic information
- CAS
66898-60-0- Standard SMILES
CC(=O)Oc1ccccc1C(=O)OC1OC(=O)c2ccccc21- InChIKey
SHCYQUDTKWHARF-UHFFFAOYSA-N- Molecular formula
- C17H12O6
- Average molar mass
- 312.27 g/mol
- Monoisotopic mass
- 312.0633881
Names & identifiers
- Preferred name
- Talosalate
- IUPAC
- (3-oxo-1H-2-benzofuran-1-yl) 2-acetyloxybenzoate
- English name
- Talosalate
- Molecular formula
- C17H12O6
- Molecular weight
- 312.27
Names & synonyms
Talosalate66898-60-0Talosalato(3-oxo-1H-2-benzofuran-1-yl) 2-acetyloxybenzoatePhthalidyl salicylate, acetateBA 7604-02BA-7604-021356SD6O2GTalosalatumTalosalate [USAN:INN]Talosalatum [INN-Latin]Talosalato [INN-Spanish]
Show more names
2-Acetoxybenzoic acid 1,3-dihydro-3-oxoisobenzofuran-1-yl esterBenzoic acid, 2-(acetyloxy)-, 1,3-dihydro-3-oxo-1-isobenzofuranyl ester
Phthalidyl 2-acetoxybenzoateUNII-1356SD6O2GTALOSALATE [INN]Talosalate (USAN/INN)TALOSALATE [USAN]SCHEMBL42842orb1740578Salicylic acid acetate, ester with 3-hydroxyphthalide
Database identifiers
- CAS
66898-60-0- PubChem CID
- 68558
- DTXSID
DTXSID20867253- ChEMBL
CHEMBL2107476- UNII
- 1356SD6O2G
- Nikkaji
- J19.137J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 487
Physicochemical properties
- FDA UNII
- 1356 SD6O2G · 1356SD6O2G
Chemistry & industry
Applications
UsesAnalgesic; anti-inflammatory.
UsesTalosalate is an inhibitor of blood platelet aggregation.
Suppliers2 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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