d1401ff3a38e9698…
CompoundID:
2244367 bytesFirst seen Jun 12, 20261 collectionFields
| Name | Value |
|---|---|
| cid | 2244 |
| exactMass | 180.04225873 |
| hBondAcceptors | 4 |
| hBondDonors | 1 |
| inchiKey | BSYNRYMUTXBXSQ-UHFFFAOYSA-N |
| iupacName | 2-acetyloxybenzoic acid |
| molecularFormula | C9H8O4 |
| molecularWeight | 180.16 |
| name | aspirin |
| pubchemUrl | https://pubchem.ncbi.nlm.nih.gov/compound/2244 |
| rotatableBonds | 3 |
| smiles | null |
| xLogP | 1.2 |
Canonical JSON
{
"id": "2244",
"type": "Compound",
"data": {
"cid": 2244,
"exactMass": 180.04225873,
"hBondAcceptors": 4,
"hBondDonors": 1,
"inchiKey": "BSYNRYMUTXBXSQ-UHFFFAOYSA-N",
"iupacName": "2-acetyloxybenzoic acid",
"molecularFormula": "C9H8O4",
"molecularWeight": 180.16,
"name": "aspirin",
"pubchemUrl": "https://pubchem.ncbi.nlm.nih.gov/compound/2244",
"rotatableBonds": 3,
"smiles": null,
"xLogP": 1.2
}
}Appears in 1 collection
nih/pubchem-compounds1 version · Jun 12, 2026
Full hash:d1401ff3a38e96986c923f1856327acb6878337f7f456d4eafa341012e78f366