OAC
Summary
| Name: | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE |
| Formula: | C10 H12 O3 |
| Formal charge: | 0 |
| Formula weight: | 180.2 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R)-3-(2-hydroxyphenyl)-2-methylpropanoic acid |
| OpenEye OEToolkits | 1.5.0 | 3-(2-hydroxyphenyl)-2-methyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(Cc1ccccc1O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](Cc1ccccc1O)C(O)=O |
| SMILES | CACTVS | 3.341 | C[CH](Cc1ccccc1O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(Cc1ccccc1O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(Cc1ccccc1O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C10H12O3/c1-7(10(12)13)6-8-4-2-3-5-9(8)11/h2-5,7,11H,6H2,1H3,(H,12,13)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | HGNFDPZASRDVLL-SSDOTTSWSA-N |
