Isopropyl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
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Basic information
- CAS
825602-92-4- Standard SMILES
CC(C)OC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1c(Cl)cccc1Cl- InChIKey
FQACVCUXLWECJC-UHFFFAOYSA-N- Molecular formula
- C19H17Cl2NO6
- Average molar mass
- 426.2 g/mol
- Monoisotopic mass
- 425.0432927
Names & identifiers
- Preferred name
- Isopropyl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
- IUPAC
- propan-2-yl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylate
- English name
- isopropyl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
- Molecular formula
- C19H17Cl2NO6
- Molecular weight
- 426.24738
Names & synonyms
isopropyl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate825602-92-4AM-807/42859842AKOS003678941ST071815methylethyl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3 ,2-b]pyran-3-carboxylatepropan-2-yl 2-amino-4-(2,6-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylate
Database identifiers
- CAS
825602-92-4- PubChem CID
- 11838597
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 762
Related reactions
0 records
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Compound notes
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