3-Chloro-2,4-hexadienedioic acid
(2Z,4E)-3-chlorohexa-2,4-dienedioic acid
Also Known As: 3-chloromuconic acid|3-Chloro-2,4-hexadienedioic acid|3-chlorohexa-2,4-dienedioic acid|3-chloro-trans,trans-muconic acid|(2Z,4E)-3-chlorohexa-2,4-dienedioic acid|2,4-Hexadienedioic acid, 3-chloro-|Benzoyl(cyclohexyloxy)carbonylperoxide|J1.348.209H
CAS: 21186-49-2
| 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 | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.98764 |
| Monoisotopic Mass | 175.98764 |
| Heavy Atoms | 11 |
| Complexity | 228.73679 |
Chemical Identifiers
| CAS Number | 21186-49-2 |
|---|---|
| SMILES | C(=C/C(=O)O)\C(=C\C(=O)O)\Cl |
Product Overview
3-Chloro-2,4-hexadienedioic acid (CAS 21186-49-2), with molecular formula C6H5ClO4 and molecular weight 175.98764 g/mol. IUPAC: (2Z,4E)-3-chlorohexa-2,4-dienedioic 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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3-Chloro-2,4-hexadienedioic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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