CCM
Summary
| Name: | 1-METHYL-1-CARBOXY-CYCLOPENTANE |
| Formula: | C7 H12 O2 |
| Formal charge: | 0 |
| Formula weight: | 128.169 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-methylcyclopentanecarboxylic acid |
| OpenEye OEToolkits | 1.5.0 | 1-methylcyclopentane-1-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C1(C)CCCC1 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1(CCCC1)C(O)=O |
| SMILES | CACTVS | 3.341 | CC1(CCCC1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1(CCCC1)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1(CCCC1)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C7H12O2/c1-7(6(8)9)4-2-3-5-7/h2-5H2,1H3,(H,8,9) |
| InChIKey | InChI | 1.03 | MNIBBVOEXUQHFF-UHFFFAOYSA-N |
