P-Xylene
Representations & DB's id
| ||
| ChEBI: | CHEBI:27417 | |
|---|---|---|
| ChEMBL: | CHEMBL31561 | |
| PubChem: | 7809 | |
| IUPAC: | 1,4-xylene | |
| Standard InChI: | InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3 | |
| Standard InChI Key: | URLKBWYHVLBVBO-UHFFFAOYSA-N | |
| SMILES: | Cc1ccc(cc1)C | |
Molecular propeties
| ||
| AlogP: | 2.3 | |
|---|---|---|
| Hydrogen bonds acceptors: | 0 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 1 | |
| Molecular Weight: | 106.08 | |
| Topological polar surface area: | 0 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 8 | |