HCI
Summary
| Name: | HYDROCINNAMIC ACID |
| Synonyms: | 3PP 3-PHENYLPROPIONIC ACID |
| Formula: | C9 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 150.174 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-phenylpropanoic acid |
| OpenEye OEToolkits | 1.7.6 | 3-phenylpropanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCc1ccccc1 |
| InChI | InChI | 1.03 | InChI=1S/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) |
| InChIKey | InChI | 1.03 | XMIIGOLPHOKFCH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)CCc1ccccc1 |
| SMILES | CACTVS | 3.370 | OC(=O)CCc1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CCC(=O)O |
