2,4-Dichloro-6-methoxyphenol
Basic information
- CAS
16766-31-7- Standard SMILES
COc1cc(Cl)cc(Cl)c1O- InChIKey
RHQIMIYFOSAUQT-UHFFFAOYSA-N- Molecular formula
- C7H6Cl2O2
- Average molar mass
- 193.02 g/mol
- Monoisotopic mass
- 191.9744848
Names & identifiers
- Preferred name
- 2,4-Dichloro-6-methoxyphenol
- IUPAC
- 2,4-dichloro-6-methoxyphenol
- English name
- 4,6-Dichloroguaiacol
- Molecular formula
- C7H6Cl2O2
- Molecular weight
- 193.03
Names & synonyms
4,6-dichloroguaiacol2,4-DICHLORO-6-METHOXYPHENOL16766-31-7Phenol, 2,4-dichloro-6-methoxy-MFCD247134914,6-Dichloro-guaiacol2,4-dichloro-6-methoxy-phenol3,5-Dichloroguaiacol2,4-Dichloro-6-methoxylphenolorb1691535SCHEMBL9332746DTXSID30168344
Show more names
2,4-Dichloro-6-methoxyphenol #AKOS040756979AS-93253SY391357HY-133608CS-0128389G67373T39145
Database identifiers
- CAS
16766-31-7- PubChem CID
- 28051
- DTXSID
DTXSID30168344- Nikkaji
- J593.431A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Melting point
- 63 · 63-64 °C(Solv: ligroine (8032-32-4))
- Boiling point
- 255.8 · 255.8±35.0 °C(Predicted)
- Density
- 1.421 · 1.421±0.06 g/cm3(Predicted)
- pka
- 8.07 · 8.07±0.23(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses4,6-Dichloroguaiacol induces biochemical and morphological changes in human peripheral blood lymphocytes in vitro[1].
Suppliers
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Related reactions
1 records
Compound notes
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