3-(2,5-dimethoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
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Basic information
- CAS
956206-42-1- Standard SMILES
COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C=O)c1- InChIKey
CAULXXFRRNKBET-UHFFFAOYSA-N- Molecular formula
- C18H16N2O3
- Average molar mass
- 308.3 g/mol
- Monoisotopic mass
- 308.11609238
Names & identifiers
- Preferred name
- 3-(2,5-dimethoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
- IUPAC
- 3-(2,5-dimethoxyphenyl)-1-phenylpyrazole-4-carbaldehyde
- English name
- 3-(2,5-DIMETHOXYPHENYL)-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE
- Molecular formula
- C18H16N2O3
- Molecular weight
- 308.33
Names & synonyms
3-(2,5-dimethoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde956206-42-13-(2,5-dimethoxyphenyl)-1-phenylpyrazole-4-carbaldehydeAKOS030748341CS-0221713EN300-09862G24143AB00728492-01Z563470953-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbaldehyde1H-Pyrazole-4-carboxaldehyde, 3-(2,5-dimethoxyphenyl)-1-phenyl-
Database identifiers
- CAS
956206-42-1- PubChem CID
- 3758955
- EC Number
- 188-702-4
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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