PDI
Summary
| Name: | PHOSPHORIC ACID MONO-(3-HYDROXY-PROPYL) ESTER |
| Formula: | C3 H9 O5 P |
| Formal charge: | 0 |
| Formula weight: | 156.074 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-hydroxypropyl dihydrogen phosphate |
| OpenEye OEToolkits | 1.5.0 | 3-hydroxypropyl dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)OCCCO |
| SMILES_CANONICAL | CACTVS | 3.341 | OCCCO[P](O)(O)=O |
| SMILES | CACTVS | 3.341 | OCCCO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CO)COP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(CO)COP(=O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C3H9O5P/c4-2-1-3-8-9(5,6)7/h4H,1-3H2,(H2,5,6,7) |
| InChIKey | InChI | 1.03 | HYCSHFLKPSMPGO-UHFFFAOYSA-N |
