1-Methyl-3,5-bis(3-methylphenyl)-1H-pyrazol-4-ol
Basic information
- CAS
60627-42-1- Standard SMILES
Cc1cccc(-c2nn(C)c(-c3cccc(C)c3)c2O)c1- InChIKey
BHHKELMGQVAAPG-UHFFFAOYSA-N- Molecular formula
- C18H18N2O
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.1419132
Names & identifiers
- Preferred name
- 1-Methyl-3,5-bis(3-methylphenyl)-1H-pyrazol-4-ol
- IUPAC
- 1-methyl-3,5-bis(3-methylphenyl)pyrazol-4-ol
Names & synonyms
60627-42-11-Methyl-3,5-bis(3-methylphenyl)-1H-pyrazol-4-olDTXSID70821825
Database identifiers
- CAS
60627-42-1- PubChem CID
- 71400554
- DTXSID
DTXSID70821825
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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