Benzoic acid 3-methyl-2-butenyl ester
- Product NameBenzoic acid 3-methyl-2-butenyl ester
- CAS5205-11-8
- MFC12H14O2
- MW190.24
- EINECS225-998-7
- MOL File5205-11-8.mol
Chemical Properties
| Boiling point | 107 °C / 2.3mmHg |
| Density | 1.03 |
| refractive index | 1.5190-1.5210 |
| FEMA | 4203 | PRENYL BENZOATE |
| Flash point | 134 °C |
| form | clear liquid |
| Specific Gravity | 1.020 |
| color | Colorless to Light orange to Yellow |
| Odor | at 100.00 %. balsam fruity chocolate ylang tea |
| Odor Type | balsamic |
| JECFA Number | 2063 |
| Major Application | flavors and fragrances |
| Cosmetics Ingredients Functions | PERFUMING |
| InChI | 1S/C12H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3 |
| InChIKey | INVWRXWYYVMFQC-UHFFFAOYSA-N |
| SMILES | C\C(C)=C\COC(=O)c1ccccc1 |
| LogP | 4.10 |
| EPA Substance Registry System | 2-Buten-1-ol, 3-methyl-, benzoate (5205-11-8) |
Safety Information
| Hazard Codes | N |
| Risk Statements | 50 |
| Safety Statements | 61 |
| WGK Germany | WGK 2 |
| RTECS | EM9473900 |
| TSCA | TSCA listed |
| HS Code | 2916399090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Chronic 2 |