MLA
Summary
Name: | MALONIC ACID |
Synonyms: | DICARBOXYLIC ACID C3 PROPANEDIOLIC ACID; METHANEDICARBOXYLIC ACID |
Formula: | C3 H4 O4 |
Formal charge: | 0 |
Formula weight: | 104.061 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | propanedioic acid |
OpenEye OEToolkits | 1.5.0 | propanedioic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CC(=O)O |
SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)CC(O)=O |
SMILES | CACTVS | 3.341 | OC(=O)CC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(C(=O)O)C(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C(=O)O)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7) |
InChIKey | InChI | 1.03 | OFOBLEOULBTSOW-UHFFFAOYSA-N |