97b1eef99fbbb7c8…

Compound
ID: 1140348 bytesFirst seen Jun 12, 20261 collection

Fields

NameValue
cid1140
exactMass92.062600255
hBondAcceptors0
hBondDonors0
inchiKeyYXFVVABEGXRONW-UHFFFAOYSA-N
iupacNametoluene
molecularFormulaC7H8
molecularWeight92.14
nametoluene
pubchemUrlhttps://pubchem.ncbi.nlm.nih.gov/compound/1140
rotatableBonds0
smilesnull
xLogP2.7

Canonical JSON

{
  "id": "1140",
  "type": "Compound",
  "data": {
    "cid": 1140,
    "exactMass": 92.062600255,
    "hBondAcceptors": 0,
    "hBondDonors": 0,
    "inchiKey": "YXFVVABEGXRONW-UHFFFAOYSA-N",
    "iupacName": "toluene",
    "molecularFormula": "C7H8",
    "molecularWeight": 92.14,
    "name": "toluene",
    "pubchemUrl": "https://pubchem.ncbi.nlm.nih.gov/compound/1140",
    "rotatableBonds": 0,
    "smiles": null,
    "xLogP": 2.7
  }
}

Appears in 1 collection

nih/pubchem-compounds1 version · Jun 12, 2026
v1.0.0

Full hash:97b1eef99fbbb7c83e67e78ba3fa852c1ddb1d143ec60bc8084bd7bc108cf94c