Showing Metabocard for (E)-cinnamyl alcohol (BASm0001871)
| Common Name | (e)-cinnamyl alcohol |
|---|---|
| Description | trans-Cinnamyl alcohol is found in bilberry. trans-Cinnamyl alcohol is a constituent of storax and Peruvian balsam, mainly as ester of Cinnamic acid. trans-Cinnamyl alcohol is a flavouring. trans-Cinnamyl alcohol is a stabiliser |
| Structure | |
| Molecular Formula | C9H10O |
| Average Mass | 134.17510 |
| Monoisotopic Mass | 134.07316 |
| IUPAC Name | (2E)-3-phenylprop-2-en-1-ol |
| Traditional Name | Cinnamyl alcohol |
| CAS Registry Number | 4407-36-7 |
| SMILES | OC/C=C/c1ccccc1 |
| InChI Identifier | InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4+ |
| InChI Key | OOCCDEMITAIZTP-QPJJXVBHSA-N |
| CHEBI ID | CHEBI:33227 |
| HMDB ID | HMDB0029698 |
| State | Not Available |
| Water Solubility | 2.34e+00 g/l |
| logP | 1.93 |
| logS | -1.76 |
| pKa (Strongest Acidic) | 15.62 |
| pKa (Strongest Basic) | -2.53 |
| Hydrogen Acceptor Count | 1 |
| Hydrogen Donor Count | 1 |
| Polar Surface Area | 20.23 Ų |
| Rotatable Bond Count | 2 |
| Physiological Charge | 0 |
| Formal Charge | 0 |
| Refractivity | 43.19 m³·mol⁻¹ |
| Polarizability | 15.41 |