(±)-(Hydroxymethyl)phenylessigsure
Bezeichnung:(±)-(Hydroxymethyl)phenylessigsure
CAS-Nr552-63-6
Englisch Name:DL-TROPIC ACID
CBNumberCB6266101
SummenformelC9H10O3
Molgewicht166.18
MOL-Datei552-63-6.mol
Synonyma
(±)-(Hydroxymethyl)phenylessigsure
(±)-(Hydroxymethyl)phenylessigsure physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 116-118 °C(lit.) |
| Siedepunkt | 322.5±30.0 °C(Predicted) |
| Dichte | 1.262±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| Löslichkeit | methanol: 0.1 g/mL, clear |
| Aggregatzustand | Solid |
| pka | pKa 3.38(H2O t = 25 c = 0.03–0.001) (Uncertain) |
| Farbe | White to Off-White |
| Wasserlöslichkeit | Soluble in water (20 g/L) at 20°C, ethanol, ether, alcohol, and methanol (0.1 g/ml). |
| Merck | 14,9779 |
| BRN | 2209199 |
| Stabilität | Stable. Combustible. Incompatible with strong oxidizing agents. |
| InChI | InChI=1S/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12) |
| InChIKey | JACRWUWPXAESPB-UHFFFAOYSA-N |
| SMILES | C(C1C=CC=CC=1)(CO)C(=O)O |
| LogP | 0.280 (est) |
| EPA chemische Informationen | Tropic acid (552-63-6) |
