Methyl L-xylo-2-hexulosonate
methyl (3S,4R,5S)-3,4,5,6-tetrahydroxy-2-oxohexanoate
Also Known As: Methyl 2-keto-L-gulonate|Provitamin C|Methyl L-xylo-hexulosonate|methyl L-sorbosonate|(3S,4R,5S)-Methyl 3,4,5,6-tetrahydroxy-2-oxohexanoate|Methyl L-xylo-2-hexulosonate|Ascorbic Acid EP Impurity D|L-xylo-2-Hexulosonic acid, methyl ester|Methyl L-xylohexulosonate|2-Keto-L-gulonic acid methyl ester|Xylohexulosonic acid, methyl ester|L-xylo-2-Hexulosonic Acid Methyl Ester|L-xylo-hexulosonic acid, methyl ester|METHYL L-XYLO-HEX-2-ULOSONATE|Gulonic acid, 2-keto-, methyl ester, L-|methyl (3S,4R,5S)-3,4,5,6-tetrahydroxy-2-oxohexanoate|ASCORBIC ACID IMPURITY D [EP IMPURITY]|2-KETO-L-GULONIC ACID METHYL ESTER [MI]|methyl (3S,4R,5S)-3,4,5,6-tetrahydroxy-2-oxo-hexanoate
| Molecular Formula | C7H12O7 |
|---|---|
| Molecular Weight | 208.0583 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.0583 |
| Monoisotopic Mass | 208.0583 |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 3031-98-9 |
|---|---|
| SMILES | COC(=O)C(=O)[C@H]([C@@H]([C@H](CO)O)O)O |
| InChIKey | KPHIBLNUVRGOGU-LMVFSUKVSA-N |
Product Overview
Methyl L-xylo-2-hexulosonate (CAS 3031-98-9), with molecular formula C7H12O7 and molecular weight 208.0583 g/mol. IUPAC: methyl (3S,4R,5S)-3,4,5,6-tetrahydroxy-2-oxohexanoate.
Methyl L-xylo-2-hexulosonate is a custom synthesis product. We offer services from milligram to kilogram scale.
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