1-O-ethyl-D-glucofuranouronic acid para-ethoxyphenylhydrazide
Basic information
- CAS
78608-65-8- Standard SMILES
CCOC(=O)[C@@H](O)[C@H]1OC[C@@](O)(NNc2ccc(OCC)cc2)[C@H]1O- InChIKey
BUTCFPAPTSGMOV-FQLMCAECSA-N- Molecular formula
- C16H24N2O7
- Average molar mass
- 356.37 g/mol
- Monoisotopic mass
- 356.15835111
Names & identifiers
- Preferred name
- 1-O-ethyl-D-glucofuranouronic acid para-ethoxyphenylhydrazide
- IUPAC
- ethyl (2S)-2-[(2S,3S,4S)-4-[2-(4-ethoxyphenyl)hydrazinyl]-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetate
Names & synonyms
78608-65-81-O-Ethyl-D-glucofuranouronic acid para-ethoxyphenylhydrazideD-Glucofuranosiduronic acid, ethyl, 2-(4-ethoxyphenyl)hydrazideRefChem:76693ethyl (2S)-2-[(2S,3S,4S)-4-[2-(4-ethoxyphenyl)hydrazinyl]-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetate
Database identifiers
- CAS
78608-65-8- PubChem CID
- 192173
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 431
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Related reactions
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Compound notes
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