3OH
Summary
Name: | 3-HYDROXY-PROPANOIC ACID |
Formula: | C3 H6 O3 |
Formal charge: | 0 |
Formula weight: | 90.078 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 3-hydroxypropanoic acid |
OpenEye OEToolkits | 1.5.0 | 3-hydroxypropanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CCO |
SMILES_CANONICAL | CACTVS | 3.341 | OCCC(O)=O |
SMILES | CACTVS | 3.341 | OCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CO)C(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CO)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C3H6O3/c4-2-1-3(5)6/h4H,1-2H2,(H,5,6) |
InChIKey | InChI | 1.03 | ALRHLSYJTWAHJZ-UHFFFAOYSA-N |