BU3
Summary
| Name: | (R,R)-2,3-BUTANEDIOL |
| Formula: | C4 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 90.121 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R,3R)-butane-2,3-diol |
| OpenEye OEToolkits | 1.5.0 | (2R,3R)-butane-2,3-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OC(C)C(O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](O)[C@@H](C)O |
| SMILES | CACTVS | 3.341 | C[CH](O)[CH](C)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H]([C@@H](C)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C(C)O)O |
| InChI | InChI | 1.03 | InChI=1S/C4H10O2/c1-3(5)4(2)6/h3-6H,1-2H3/t3-,4-/m1/s1 |
| InChIKey | InChI | 1.03 | OWBTYPJTUOEWEK-QWWZWVQMSA-N |
