4,6-Dichloro-3-methylcatechol
Basic information
- CAS
374591-33-0- Standard SMILES
Cc1c(Cl)cc(Cl)c(O)c1O- InChIKey
WHZYTTYRNXQNQF-UHFFFAOYSA-N- Molecular formula
- C7H6Cl2O2
- Average molar mass
- 193.02 g/mol
- Monoisotopic mass
- 191.9744848
Overview
4,6-Dichloro-3-methylcatechol is a chlorocatechol.
Names & identifiers
- Preferred name
- 4,6-Dichloro-3-methylcatechol
- IUPAC
- 4,6-dichloro-3-methylbenzene-1,2-diol
Names & synonyms
4,6-Dichloro-3-methylcatechol374591-33-0DTXSID10429485RefChem:96625DTXCID403803184,6-dichloro-3-methylbenzene-1,2-diolCHEBI:81653C18302Q27155534
Database identifiers
- CAS
374591-33-0- PubChem CID
- 9543293
- DTXSID
DTXSID10429485- ChEBI
CHEBI:81653- Nikkaji
- J1.808.477E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 142
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Related reactions
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Compound notes
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