1,3,4,5,6-Pentachlorocyclohexene-1-oxide
(1S,2S,3R,4S,5S,6R)-1,2,3,4,5-pentachloro-7-oxabicyclo[4.1.0]heptane
Also Known As: PCHO|1,3,4,5,6-Pentachlorocyclohexene-1-oxide|1,2,3,4,5-Pentachloro-7-oxabicyclo[4.1.0]heptane|-1,2,3,4,5-pentachloro-7-oxabicyclo[4.1.0]heptane|(1R,2S,3S,4R,5S,6S)-2,3,4,5,6-pentachloro-7-oxabicyclo[4.1.0]heptane|(1S,2S,3R,4S,5S,6R)-1,2,3,4,5-PENTACHLORO-7-OXABICYCLO[4.1.0]HEPTANE|7-Oxabicyclo(4.1.0)heptane, 1,2,3,4,5-pentachloro-, (1alpha,2beta,3alpha,4beta,5beta,6alpha)-
| Molecular Formula | C6H5Cl5O |
|---|---|
| Molecular Weight | 267.8783 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.8783 |
| Monoisotopic Mass | 267.8783 |
| Heavy Atoms | 12 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 93672-46-9 |
|---|---|
| SMILES | [C@@H]1([C@H]([C@@H]2[C@@](O2)([C@H]([C@@H]1Cl)Cl)Cl)Cl)Cl |
| InChIKey | BHHXTWQURUPAAI-GTTIYYRPSA-N |
Product Overview
1,3,4,5,6-Pentachlorocyclohexene-1-oxide (CAS 93672-46-9), with molecular formula C6H5Cl5O and molecular weight 267.8783 g/mol. IUPAC: (1S,2S,3R,4S,5S,6R)-1,2,3,4,5-pentachloro-7-oxabicyclo[4.1.0]heptane.
1,3,4,5,6-Pentachlorocyclohexene-1-oxide is a custom synthesis product. We offer services from milligram to kilogram scale.
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