XPM
Summary
| Name: | tetradecylpropanedioic acid |
| Formula: | C17 H32 O4 |
| Formal charge: | 0 |
| Formula weight: | 300.434 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | tetradecylpropanedioic acid |
| OpenEye OEToolkits | 1.7.2 | 2-tetradecylpropanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(C(=O)O)CCCCCCCCCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C17H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16(18)19)17(20)21/h15H,2-14H2,1H3,(H,18,19)(H,20,21) |
| InChIKey | InChI | 1.03 | SMTKGALBDOEZCA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCCCCCCC(C(O)=O)C(O)=O |
| SMILES | CACTVS | 3.370 | CCCCCCCCCCCCCCC(C(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCCCCCCCCCCCCCC(C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCCCCCCCCCCCCC(C(=O)O)C(=O)O |
