Tritox 50
Basic information
- CAS
8068-36-8- Standard SMILES
COc1ccc(C(c2ccc(OC)cc2)C(Cl)(Cl)Cl)cc1.ClC1C(Cl)C(Cl)C(Cl)C(Cl)C1Cl.Clc1ccc(C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl)cc1- InChIKey
RWMJZZIENLZZJH-UHFFFAOYSA-N- Molecular formula
- C36H30Cl14O2
- Average molar mass
- 990.9 g/mol
- Monoisotopic mass
- 983.788518
Names & identifiers
- Preferred name
- Tritox 50
- IUPAC
- 1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene;1,2,3,4,5,6-hexachlorocyclohexane;1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene
Names & synonyms
Tritox 508068-36-8Benzene, 1,1'-(2,2,2-trichloroethylidene)bis(4-chloro-, mixt. with (1alpha,2alpha,3beta,4aalpha,5alpha,6beta)-1,2,3,4,5,6-hexachlorocyclohexane and 1,1'-(2,2,2-trichloroethylidene)bis(4-methoxybenzene)
Database identifiers
- CAS
8068-36-8- PubChem CID
- 119063
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 633
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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