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Basic information
- CAS
20624-96-8- Standard SMILES
COc1c(O)c(OC)c(Cl)c(C(=O)O)c1Cl- InChIKey
QBIVVENRSKQCDU-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O5
- Average molar mass
- 267.06 g/mol
- Monoisotopic mass
- 265.9748787
Names & identifiers
- Preferred name
- Benzoic acid, 2,6-dichloro-4-hydroxy-3,5-dimethoxy-
- IUPAC
- 2,6-dichloro-4-hydroxy-3,5-dimethoxybenzoic acid
Names & synonyms
20624-96-8Benzoic acid, 2,6-dichloro-4-hydroxy-3,5-dimethoxy-2,6-DICHLORO-4-HYDROXY-3,5-DIMETHOXYBENZOIC ACIDDTXSID60174630
Database identifiers
- CAS
20624-96-8- PubChem CID
- 30205
- DTXSID
DTXSID60174630- Nikkaji
- J1.609.060C
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
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Compound notes
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