Substance
- Substance Name: 1,1,2,3,4,4-hexachloro-1,3-butadiene
- Formula: C4Cl6
- Molecular Weight: 260.8 g/mol
- Identifiers:
- inchi: InChI=1S/C4Cl6/c5-1(3(7)8)2(6)4(9)10
- inchikey: RWNKSTSCBHKHTB-UHFFFAOYSA-N
- casrn: 25668-23-9
- csmiles: C(=C(Cl)Cl)(C(=C(Cl)Cl)Cl)Cl
- ismiles: C(=C(Cl)Cl)(C(=C(Cl)Cl)Cl)Cl
- pubchemId: 6901
- iupacname: 1,1,2,3,4,4-hexachlorobuta-1,3-diene
- wikidataId: Q416393
- chemspiderId: 6635
- dsstoxcmpId: DTXCID10683
- chemblId: CHEMBL389950
- ecnumber: 201-765-5
1,1,2,3,4,4-hexachloro-1,3-butadiene
Systems and Datasets
- 1,1,2,3,4,4-hexachloro-1,3-butadiene + water (Datasets: 2)
- Dataset 1 in paper 10.1021/acs.jced.7b00320 (Dataseries: 1, Datapoints: 5, Quantity: Mole fraction)
- Dataset 81 in paper 10.1021/je3010535 (Dataseries: 1, Datapoints: 7, Quantity: Henry's Law constant (molality scale))