| benzenecarboxylic acid; benzoic acid | |
| Links: | 🌍 Wikipedia, 📏 NIST, 🕷 ChemSpider, ⚗️ ChemSynthesis, 📖 PubMed, 📖Houben-Weyl, 2. Band (Benzoesäure); p. 12, 30, 78, 126, 132, 278, 299, 358, 428, 439, 446, 453, 459, 886, 910, 994, 1002 |
| MeSH: | Anti-Infective Agents; Food Additives; Food Preservatives |
| CAS RN: | [65-85-0] |
| Formula: | C7H6O2; 122.12 g/mol |
| InChiKey: | WPYMKLBDIGXBTP-UHFFFAOYSA-N |
| SMILES: | OC(=O)c1ccccc1 |
| Density: | 1.320 g/mL |
| Molar volume: | 92.5 mL/mol |
| Refractive index: | 1.540 |
| Molecular refractive power: | 29.01 mL/mol |
| Dipole moment: | 1.72 D |
| Melting point: | 121 °C |
| Boiling point: | 249 °C |
| Antoine equation P(Torr) vs T(°C) | |
| Solubility in water: | 0 % w/w |
| Log10 partition octanol / water: | 2.63 |
| Hansen solubility parameter: | δd: 8.9 (cal/mL)½ δp: 3.4 (cal/mL)½ δh: 4.8 (cal/mL)½ |
| 1g dissolves in: 1.58g ethanol; 1.71g methanol; 1.80g 2-propanone; 2.14g diethyl ether; 2.43g ethyl acetate; 2.60g diethyl ether; 3.09g pentanol; 4.55g pentyl acetate; 6.61g trichloromethane; 6.67g trichloromethane; 8.18g benzene; 8.62g benzene; 9.28g 1,1,2,2-tetrachloroethane; 9.35g toluene; 9.64g trichloroethene; 9.95g nitrobenzene; 10.30g 1,3-dimethylbenzene; 11.36g benzene; 11.64g cumene; 12.94g 1,2,3-propanetriol; 14.10g pentachloroethane; 18.98g tetrachloroethene; 20.75g carbon disulfide; 22.88g tetrachloromethane; 23.92g tetrachloromethane; 26.53g ethyl acetate; 28.74g carbon disulfide; 66.67g hexane; 271.74g water; 344.83g water | |