(5-Tert-butyl-2-hydroxyphenyl)(1-phenyl-1h-pyrazol-4-yl)methanone
Basic information
- CAS
288844-46-2- Standard SMILES
CC(C)(C)c1ccc(O)c(C(=O)c2cnn(-c3ccccc3)c2)c1- InChIKey
DDNZTZZNSFQWCM-UHFFFAOYSA-N- Molecular formula
- C20H20N2O2
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.15247789
Names & identifiers
- Preferred name
- (5-Tert-butyl-2-hydroxyphenyl)(1-phenyl-1h-pyrazol-4-yl)methanone
- IUPAC
- (5-tert-butyl-2-hydroxyphenyl)-(1-phenylpyrazol-4-yl)methanone
- English name
- (5-tert-Butyl-2-hydroxyphenyl)(1-phenyl-1H-pyrazol-4-yl)methanone
- Molecular formula
- C20H20N2O2
- Molecular weight
- 320.39
Names & synonyms
288844-46-2(5-tert-butyl-2-hydroxyphenyl)(1-phenyl-1h-pyrazol-4-yl)methanone(5-(tert-Butyl)-2-hydroxyphenyl)(1-phenyl-1H-pyrazol-4-yl)methanoneDTXSID20695472DB-0474844-(5-TERT-BUTYL-2-HYDROXYBENZOYL)-1-PHENYLPYRAZOLE
Database identifiers
- CAS
288844-46-2- PubChem CID
- 53405035
- DTXSID
DTXSID20695472
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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