Basic information
- Standard SMILES
COC(=O)c1cc(Cl)c(OC)cc1OC- InChIKey
CYBZPSKAYVKEEA-UHFFFAOYSA-N- Molecular formula
- C10H11ClO4
- Average molar mass
- 230.64 g/mol
- Monoisotopic mass
- 230.0345865
Names & identifiers
- Preferred name
- Methyl 5-chloro-2,4-dimethoxybenzoate
- IUPAC
- methyl 5-chloro-2,4-dimethoxybenzoate
Names & synonyms
methyl 5-chloro-2,4-dimethoxybenzoate174261-01-9MFCD24108547SCHEMBL8900419CYBZPSKAYVKEEA-UHFFFAOYSA-Nmethyl5-chloro-2,4-dimethoxybenzoateAKOS020024499methyl 5-chloro-2,4-dimethoxy-benzoateCS-0191174E92810F629120
Database identifiers
- PubChem CID
- 21477059
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 221
Related reactions
4 records
Compound notes
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