Heptyl-4-hydroxybenzoat
Bezeichnung:Heptyl-4-hydroxybenzoat
CAS-Nr1085-12-7
Englisch Name:Heptyl 4-hydroxybenzoate
CBNumberCB9666375
SummenformelC14H20O3
Molgewicht236.31
MOL-Datei1085-12-7.mol
Synonyma
Heptyl-4-hydroxybenzoat
Heptyl-4-hydroxybenzoat physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 46-51 °C |
| Siedepunkt | 338.77°C (rough estimate) |
| Dichte | 1.0717 (rough estimate) |
| Brechungsindex | 1.5800 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| pka | 8.23±0.15(Predicted) |
| Aggregatzustand | Solid |
| Farbe | White to Off-White |
| Wasserlöslichkeit | Soluble in alcohol, phenoxyethanol, propylene glycol. Insoluble in water. |
| InChI | 1S/C14H20O3/c1-2-3-4-5-6-11-17-14(16)12-7-9-13(15)10-8-12/h7-10,15H,2-6,11H2,1H3 |
| InChIKey | ZTJORNVITHUQJA-UHFFFAOYSA-N |
| SMILES | CCCCCCCOC(=O)c1ccc(O)cc1 |
| LogP | 4.830 |
| CAS Datenbank | 1085-12-7(CAS DataBase Reference) |
| NIST chemische Informationen | Benzoic acid, 4-hydroxy-, n-heptyl ester(1085-12-7) |
| EPA chemische Informationen | Benzoic acid, 4-hydroxy-, heptyl ester (1085-12-7) |
| Kennzeichnung gefährlicher | Xi |
| R-Sätze: | 36/37/38 |
| S-Sätze: | 37/39-26-37 |
| WGK Germany | WGK 3 |
| RTECS-Nr. | DH2202000 |
| TSCA | TSCA listed |
| HS Code | 29182900 |
| Speicherklasse | 11 - Combustible Solids |
