4Y8
Summary
| Name: | 1-hydroxypropan-2-one |
| Formula: | C3 H6 O2 |
| Formal charge: | 0 |
| Formula weight: | 74.079 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-hydroxypropan-2-one |
| OpenEye OEToolkits | 1.9.2 | 1-oxidanylpropan-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(C)CO |
| InChI | InChI | 1.03 | InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3 |
| InChIKey | InChI | 1.03 | XLSMFKSTNGKWQX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)CO |
| SMILES | CACTVS | 3.385 | CC(=O)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC(=O)CO |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC(=O)CO |
