2-Chloro-4-(3,4-dichlorophenyl)phenol
Basic information
- CAS
124882-64-0- Standard SMILES
Oc1ccc(-c2ccc(Cl)c(Cl)c2)cc1Cl- InChIKey
VQMNVNJOJQZHKW-UHFFFAOYSA-N- Molecular formula
- C12H7Cl3O
- Average molar mass
- 273.5 g/mol
- Monoisotopic mass
- 271.956248
Names & identifiers
- Preferred name
- 2-Chloro-4-(3,4-dichlorophenyl)phenol
- IUPAC
- 2-chloro-4-(3,4-dichlorophenyl)phenol
Names & synonyms
2-chloro-4-(3,4-dichlorophenyl)phenol124882-64-0DTXSID00154512RefChem:258676DTXCID60770034'-OH-CB35MFCD11933767SCHEMBL7906570AKOS0175657964-hydroxy-3,3',4'-trichloro biphenyl3,3',4'-Trichloro[1,1'-biphenyl]-4-olNS00126084
Show more names
2-Chloro-4-(3,4-dichlorophenyl)phenol, 95%
Database identifiers
- CAS
124882-64-0- PubChem CID
- 180285
- DTXSID
DTXSID00154512- Nikkaji
- J2.454.662D
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Experimental & physicochemical properties
Collision Cross Section155.48 Ų [M-H]- [CCS Type: cIM (TWIMS); Drift Gas: nitrogen; Method: calibrated with in-house mix]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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