| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2005 | 10 | Yes |
Popular Name: 3-methyl-5-(trifluoromethyl)pyrazole 3-methyl-5-(trifluoromethyl)pyra…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10010-93-2 , 942060-04-0 , [10010-93-2] , [942060-04-0]
"3-Methyl-5-trifluoromethyl-1H-pyrazole, 97%"
1H-Pyrazole, 3-methyl-5-(trifluoromethyl)-
1H-Pyrazole, 5-methyl-3-(trifluoromethyl)-
3-methyl-5-(trifluoromethyl)-1H-pyrazole
3-Methyl-5-(trifluoromethyl)pyrazole, 99%
3-Methyl-5-trifluoromethyl-1H-pyrazole
5-methyl-3-(trifluoromethyl)-1H-pyrazole
5-Methyl-3-trifluoromethyl-1H-pyrazole
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.68 | 2.5 | -3.53 | 1 | 2 | 0 | 29 | 150.103 | 1 | ↓ |
| Ref Reference (pH 7) | 1.68 | 2.5 | -5.78 | 1 | 2 | 0 | 29 | 150.103 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 88 - 90 | Acros Organics |
| Melting_Point | 88-90? | Alfa-Aesar |
| MP | 88-90° | Oakwood Chemical |
| MP | 89 | TCI |
| melting_point | 89 - 91 | KeyOrganics |
| MP | 89-90° | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H315: Causes skin irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P305 + P35 | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| PUBCHEM_PATENT_ID | US5849754; WO1998022463A1; WO2000018851A1 | IBM Patent Data |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.