Basic information
- Standard SMILES
O=Cc1ccc(OC2(C(=O)O)CCC2)c(Cl)c1Cl- InChIKey
PFHRAVHULNTWFI-UHFFFAOYSA-N- Molecular formula
- C12H10Cl2O4
- Average molar mass
- 289.11 g/mol
Names & identifiers
- Preferred name
- 1-(2,3-Dichloro-4-formylphenoxy)cyclobutane-1-carboxylic acid
- IUPAC
- 1-(2,3-dichloro-4-formylphenoxy)cyclobutane-1-carboxylic acid
Names & synonyms
SCHEMBL9717633PFHRAVHULNTWFI-UHFFFAOYSA-N1-(2,3-dichloro-4-formylphenoxy)cyclobutane-1-carboxylic acid
Database identifiers
- PubChem CID
- 20135556
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 343
Related reactions
2 records
Compound notes
Loading…