2-CHLORO-2,4,6-CYCLOHEPTATRIEN-1-ONE
2-chlorocyclohepta-2,4,6-trien-1-one
CAS: 3839-48-3
| Molecular Formula | C7H5ClO |
|---|---|
| Molecular Weight | 140.56 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 17.1 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.0029 |
| Heavy Atoms | 9 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 3839-48-3 |
|---|---|
| SMILES | C1=CC=C(C(=O)C=C1)Cl |
| InChIKey | MTHNMAUDCHXFMM-UHFFFAOYSA-N |
📖 Product Overview
2-CHLORO-2,4,6-CYCLOHEPTATRIEN-1-ONE (CAS: 3839-48-3) is a chemical compound with molecular formula C7H5ClO and molecular weight 140.56 g/mol. Its IUPAC systematic name is 2-chlorocyclohepta-2,4,6-trien-1-one.
MTHNMAUDCHXFMM-UHFFFAOYSA-N.
SMILES: C1=CC=C(C(=O)C=C1)Cl.
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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What documentation do you provide with the product?
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📚 Academic Support
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