SU8
Summary
| Name: | (2R)-2-butylbutanedioic acid |
| Synonyms: | (2R)-2-butylsuccinic acid |
| Formula: | C8 H14 O4 |
| Formal charge: | 0 |
| Formula weight: | 174.194 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2-butylbutanedioic acid |
| OpenEye OEToolkits | 1.7.6 | (2R)-2-butylbutanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(CC(=O)O)CCCC |
| InChI | InChI | 1.03 | InChI=1S/C8H14O4/c1-2-3-4-6(8(11)12)5-7(9)10/h6H,2-5H2,1H3,(H,9,10)(H,11,12)/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | WOPLHDNLGYOSPG-ZCFIWIBFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCC[C@H](CC(O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | CCCC[CH](CC(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCC[C@H](CC(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCCC(CC(=O)O)C(=O)O |
