XH4
Summary
| Name: | [(3R)-pyrazolidin-3-yl]methanol |
| Formula: | C4 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 102.135 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | [(3R)-pyrazolidin-3-yl]methanol |
| OpenEye OEToolkits | 2.0.7 | [(3~{S})-pyrazolidin-3-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OCC1NNCC1 |
| InChI | InChI | 1.03 | InChI=1S/C4H10N2O/c7-3-4-1-2-5-6-4/h4-7H,1-3H2/t4-/m1/s1 |
| InChIKey | InChI | 1.03 | FBDFRVVUQCCDAI-SCSAIBSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@@H]1CCNN1 |
| SMILES | CACTVS | 3.385 | OC[CH]1CCNN1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CNN[C@@H]1CO |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CNNC1CO |
