ethyl [3-(1H-pyrazol-4-yl)phenyl]acetate
Basic information
- Standard SMILES
CCOC(=O)Cc1cccc(-c2cn[nH]c2)c1- InChIKey
FIPHAVHPWQCZLM-UHFFFAOYSA-N- Molecular formula
- C13H14N2O2
- Average molar mass
- 230.26 g/mol
Names & identifiers
- Preferred name
- ethyl [3-(1H-pyrazol-4-yl)phenyl]acetate
- IUPAC
- ethyl 2-[3-(1H-pyrazol-4-yl)phenyl]acetate
Names & synonyms
FIPHAVHPWQCZLM-UHFFFAOYSA-Nethyl [3-(1H-pyrazol-4-yl)phenyl]acetate
Database identifiers
- PubChem CID
- 86731998
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 258
Related reactions
2 records
Compound notes
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