PHT
Summary
| Name: | PHTHALIC ACID |
| Formula: | C8 H6 O4 |
| Formal charge: | 0 |
| Formula weight: | 166.131 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | benzene-1,2-dicarboxylic acid |
| OpenEye OEToolkits | 1.5.0 | phthalic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c1ccccc1C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)c1ccccc1C(O)=O |
| SMILES | CACTVS | 3.341 | OC(=O)c1ccccc1C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)C(=O)O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12) |
| InChIKey | InChI | 1.03 | XNGIFLGASWRNHJ-UHFFFAOYSA-N |
