5-Chloro-2-hydroxymuconic semialdehyde
(3E,5Z)-5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid
Also Known As: 5-Chloro-2-hydroxymuconic semialdehyde|5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid|2-Hydroxy-5-chloromuconic acid semialdehyde|5-chloro-2-hydroxy-6-oxohexa-2,4-dienoic acid|(3E,5Z)-5-chloro-6-hydroxy-2-oxo-hexa-3,5-dienoic acid|(3E,5Z)-5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid
CAS: 8060-80-8
| Molecular Formula | C6H5ClO4 |
|---|---|
| Molecular Weight | 175.98764 g/mol |
| LogP | 0.8345 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.98764 |
| Monoisotopic Mass | 175.98764 |
| Heavy Atoms | 11 |
| Complexity | 228.73679 |
Chemical Identifiers
| CAS Number | 8060-80-8 |
|---|---|
| SMILES | C(=C/C(=O)C(=O)O)\C(=C\O)\Cl |
Product Overview
5-Chloro-2-hydroxymuconic semialdehyde (CAS 8060-80-8), with molecular formula C6H5ClO4 and molecular weight 175.98764 g/mol. IUPAC: (3E,5Z)-5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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5-Chloro-2-hydroxymuconic semialdehyde is a custom synthesis product. We offer services from milligram to kilogram scale.
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