Basic information
- Standard SMILES
COC(=O)c1cc(-c2ccc(Cl)cc2Cl)oc1C- InChIKey
HSXNKCLNBHBGPZ-UHFFFAOYSA-N- Molecular formula
- C13H10Cl2O3
- Average molar mass
- 285.12 g/mol
Names & identifiers
- Preferred name
- Methyl 5-(2,4-dichlorophenyl)-2-methyl-3-furoate
- IUPAC
- methyl 5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxylate
Names & synonyms
SCHEMBL3107351HSXNKCLNBHBGPZ-UHFFFAOYSA-Nmethyl 5-(2,4-dichlorophenyl)-2-methyl-3-furoate
Database identifiers
- PubChem CID
- 68514435
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
Related reactions
2 records
Compound notes
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