Completing data — refresh the page later to see the latest
Basic information
- CAS
569-84-6- Standard SMILES
CC(=O)Oc1ccccc1C(=O)O.Cc1cc(=O)n(-c2ccccc2)n1C- InChIKey
DXKXOTURGHVQIW-UHFFFAOYSA-N- Molecular formula
- C20H20N2O5
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.13722174
Names & identifiers
- Preferred name
- Antipyrine acetylsalicylate
- IUPAC
- 2-acetyloxybenzoic acid;1,5-dimethyl-2-phenylpyrazol-3-one
Names & synonyms
PyrosalAntipyrine acetylsalicylateAcetopyrinAcopyrinAntipyrin acetylsalicylateUNII-QDB7SP3X8AQDB7SP3X8A569-84-6DTXSID60205438ANTIPYRINE ACETYLSALICYLATE [MI]Q272872082-(Acetyloxy)benzoic acid--1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one (1/1)
Database identifiers
- CAS
569-84-6- PubChem CID
- 20056736
- DTXSID
DTXSID60205438- UNII
- QDB7SP3X8A
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 87.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 478
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…