Basic information
- Standard SMILES
Cc1nn(C)c(C)c1C(C)(O)c1ccco1- InChIKey
MTMZBXIMROZNGA-UHFFFAOYSA-N- Molecular formula
- C12H16N2O2
- Average molar mass
- 220.27 g/mol
Names & identifiers
- Preferred name
- 1-(2-Furyl)-1-(1,3,5-trimethyl-4-pyrazolyl)ethanol
- IUPAC
- 1-(furan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
Names & synonyms
SCHEMBL8614992MTMZBXIMROZNGA-UHFFFAOYSA-N1-(2-Furyl)-1-(1,3,5-trimethyl-4-pyrazolyl)ethanol
Database identifiers
- PubChem CID
- 18936330
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 261
Related reactions
3 records
Compound notes
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