(-)-Corey lactone 4-phenylbenzoate alcohol
- Product Name(-)-Corey lactone 4-phenylbenzoate alcohol
- CAS31752-99-5
- CBNumberCB0352945
- MFC21H20O5
- MW352.38
- EINECS608-667-5
- MDL NumberMFCD00078077
- MOL File31752-99-5.mol
Chemical Properties
| Melting point: | 131-132 °C(lit.) |
| alpha | -89 º (c=1, CHCl3) |
| Boiling point: | 446°C (rough estimate) |
| Density | 1.1818 (rough estimate) |
| refractive index | 1.5400 (estimate) |
| storage temp. | 2-8°C |
| solubility | Chloroform, Ethyl Acetate |
| form | Solid |
| pka | 14.79±0.10(Predicted) |
| color | Off-White to Pale Yellow |
| optical activity | [α]20/D 87°, c = 1 in chloroform |
| Water Solubility | insoluble |
| BRN | 1294692 |
| InChI | 1S/C21H20O5/c22-12-17-16-10-20(23)25-18(16)11-19(17)26-21(24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,16-19,22H,10-12H2/t16-,17-,18+,19-/m1/s1 |
| InChIKey | SZJVIFMPKWMGSX-UHFFFAOYSA-N |
| SMILES | OC[C@H]1[C@@H](C[C@@H]2OC(=O)C[C@H]12)OC(=O)c3ccc(cc3)-c4ccccc4 |
| CAS DataBase Reference | 31752-99-5(CAS DataBase Reference) |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H315-H319-H335 | |||||||||
| Precautionary statements | P261-P305+P351+P338 | |||||||||
| PPE | Eyeshields, Gloves, type N95 (US) | |||||||||
| Safety Statements | 22-24/25 | |||||||||
| WGK Germany | 3 | |||||||||
| HS Code | 2932209090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| REACH Registrations | Active | |||||||||
| NFPA 704: |
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