[2,3-Dichloro-4-(1-ethoxymethyl-5-pyrazolylcarbonyl)phenoxy]acetic acid
Basic information
- Standard SMILES
CCOCn1nccc1C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl- InChIKey
NBFHHTCEVGJOHQ-UHFFFAOYSA-N- Molecular formula
- C15H14Cl2N2O5
- Average molar mass
- 373.2 g/mol
Names & identifiers
- Preferred name
- [2,3-Dichloro-4-(1-ethoxymethyl-5-pyrazolylcarbonyl)phenoxy]acetic acid
- IUPAC
- 2-[2,3-dichloro-4-[2-(ethoxymethyl)pyrazole-3-carbonyl]phenoxy]acetic acid
Names & synonyms
SCHEMBL9506410NBFHHTCEVGJOHQ-UHFFFAOYSA-N[2,3-dichloro-4-(1-ethoxymethyl-5-pyrazolylcarbonyl)phenoxy]acetic acid
Database identifiers
- PubChem CID
- 9864296
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
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Related reactions
4 records
Compound notes
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