1,2,3-Trichloro-4-(2,4,5-trichlorophenoxy)benzene
Basic information
- CAS
71585-36-9- Standard SMILES
Clc1cc(Cl)c(Oc2ccc(Cl)c(Cl)c2Cl)cc1Cl- InChIKey
PHSJJYZIFPWCLZ-UHFFFAOYSA-N- Molecular formula
- C12H4Cl6O
- Average molar mass
- 376.9 g/mol
- Monoisotopic mass
- 373.839331
Names & identifiers
- Preferred name
- 1,2,3-Trichloro-4-(2,4,5-trichlorophenoxy)benzene
- IUPAC
- 1,2,3-trichloro-4-(2,4,5-trichlorophenoxy)benzene
Names & synonyms
1,2,3-Trichloro-4-(2,4,5-trichlorophenoxy)benzeneIPP715Y09G2,2',3,4,4',5'-Hexachlorodiphenyl ether71585-38-1UNII-IPP715Y09GPCDE 138Benzene, 1,2,3-trichloro-4-(2,4,5-trichlorophenoxy)-DTXSID408770112,2',3,4,4',5'-HexachlorodiphenyletherQ27280839
Database identifiers
- CAS
71585-36-9、71585-38-1- PubChem CID
- 91709
- DTXSID
DTXSID40877011- UNII
- IPP715Y09G
- Nikkaji
- J772.324E
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 304
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP7.01
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…