[3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methanol
Completing data — refresh the page later to see the latest
Basic information
- CAS
955972-07-3- Standard SMILES
Cc1ccc(-c2nn(-c3ccccc3)cc2CO)cc1C- InChIKey
HZIUFCSZDOXXEO-UHFFFAOYSA-N- Molecular formula
- C18H18N2O
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.1419132
Names & identifiers
- Preferred name
- [3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methanol
- IUPAC
- [3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]methanol
- English name
- [3-(3,4-DIMETHYLPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]METHANOL
- Molecular formula
- C18H18N2O
- Molecular weight
- 278.35
Names & synonyms
955972-07-3[3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methanol(3-(3,4-Dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl)methanolRefChem:399543100-104-7[3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]methanolSCHEMBL11244106MFCD05987297AKOS001073259CCG-304533SY137575CS-0458296
Show more names
3-(3,4-Dimethylphenyl)-1-phenyl-1H-pyrazol-4-methanol3-(3,4-Dimethylphenyl)-1-phenyl-1H-pyrazole-4-methanol1H-Pyrazole-4-methanol, 3-(3,4-dimethylphenyl)-1-phenyl-(3-(3,4-Dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl)methanol - [D89217]
EN300-09839G20113F7781053-(3,4-Dimethylphenyl)-1-phenylpyrazole-4-methanolZ56989543[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methanol
Database identifiers
- CAS
955972-07-3- PubChem CID
- 976857
- EC Number
- 100-104-7
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 329
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…