1-Chloro-4-(2,2-dichloro-1-(4-chlorophenyl)ethenyl)-3-(methylsulfonyl)benzene
Basic information
- CAS
62938-14-1- Standard SMILES
CS(=O)(=O)c1cc(Cl)ccc1C(=C(Cl)Cl)c1ccc(Cl)cc1- InChIKey
YQCQEXWXRQQMAR-UHFFFAOYSA-N- Molecular formula
- C15H10Cl4O2S
- Average molar mass
- 396.1 g/mol
- Monoisotopic mass
- 393.915562
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1-Chloro-4-(2,2-dichloro-1-(4-chlorophenyl)ethenyl)-3-(methylsulfonyl)benzene
- IUPAC
- 4-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-2-methylsulfonylbenzene
- English name
- 1-chloro-4-(2,2-dichloro-1-(4-chlorophenyl)ethenyl)-3-(methylsulfonyl)benzene
- Molecular formula
- C15H10Cl4O2S
- Molecular weight
- 396.12
Names & synonyms
Meso2-dde3-Meso(2)-dde1-Chloro-4-(2,2-dichloro-1-(4-chlorophenyl)ethenyl)-3-(methylsulfonyl)benzene62938-14-1DTXSID20212143RefChem:75402DTXCID201346343-Methylsulfonyl-ddePD181445DB-354398NS001341252-(2-methylsulphonyl-4-chlorophenyl)-2-(4-chlorophenyl)-1,1-dichloroethene
Show more names
4-Chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethen-1-yl]-2-(methanesulfonyl)benzeneBenzene, 4-chloro-1-(2,2-dichloro-1-(4-chlorophenyl)ethenyl)-2-(methylsulfonyl)-
Database identifiers
- CAS
62938-14-1- PubChem CID
- 119115
- DTXSID
DTXSID20212143
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 514
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…