Isomalic acid
2-hydroxy-2-methylpropanedioic acid
Also Known As: Methyltartronic acid|Isomalic acid|DL-Methyltartronic acid|2-Hydroxy-2-methylpropanedioic acid|Isoapfelsaure|2-Methyltartronic acid|Tartronic acid, methyl-|2-Hydroxy-2-methylmalonic acid|hydroxymethylmalonic acid|2-Hydroxy-2-methylmalonate|Hydroxymethylpropanedioic acid|C-METHYLTARTRONIC ACID|Hydroxy(methyl)malonic acid|Propanedioic acid, hydroxymethyl-|DL-METHYLTARTRONICACID|hydroxy(methyl)propanedioic acid|METHYL TARTRONIC ACID|2-Methyltartronic acid diethyl|2-Hydroxy-2-methylmalonic acid #|2-hydroxy-2-methyl-propanedioicacid|Propanedioic acid, hydroxymethyl-(9CI)|PROPANEDIOIC ACID, 2-HYDROXY-2-METHYL-|3-03-00-00927 (Beilstein Handbook Reference)|209-868-7
| Molecular Formula | CC(C(=O)O)(C(=O)O)O |
|---|---|
| Molecular Weight | 134.02153 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.02153 |
| Monoisotopic Mass | 134.02153 |
| Heavy Atoms | 9 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 595-98-2 |
|---|---|
| SMILES | CC(C(=O)O)(C(=O)O)O |
| InChIKey | LNRVTEQEGXVMEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isomalic acid (CAS 595-98-2), with molecular formula CC(C(=O)O)(C(=O)O)O and molecular weight 134.02153 g/mol. IUPAC: 2-hydroxy-2-methylpropanedioic acid.
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