TBB
Summary
| Name: | tert-butylcarbamic acid |
| Formula: | C5 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 117.146 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | tert-butylcarbamic acid |
| OpenEye OEToolkits | 1.7.6 | tert-butylcarbamic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)NC(C)(C)C |
| InChI | InChI | 1.03 | InChI=1S/C5H11NO2/c1-5(2,3)6-4(7)8/h6H,1-3H3,(H,7,8) |
| InChIKey | InChI | 1.03 | XBXCNNQPRYLIDE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(C)(C)NC(O)=O |
| SMILES | CACTVS | 3.370 | CC(C)(C)NC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)(C)NC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)(C)NC(=O)O |
