PPT
Summary
| Name: | 3-(P-TOLYL)PROPIONIC ACID |
| Formula: | C10 H12 O2 |
| Formal charge: | 0 |
| Formula weight: | 164.201 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-(4-methylphenyl)propanoic acid |
| OpenEye OEToolkits | 1.5.0 | 3-(4-methylphenyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCc1ccc(cc1)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1ccc(CCC(O)=O)cc1 |
| SMILES | CACTVS | 3.341 | Cc1ccc(CCC(O)=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1ccc(cc1)CCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1ccc(cc1)CCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C10H12O2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12) |
| InChIKey | InChI | 1.03 | LDYGRLNSOKABMM-UHFFFAOYSA-N |
