| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | Yes |
Popular Name: 3-tert-Butyl-1-methyl-1H-pyrazol-5-amine 3-tert-Butyl-1-methyl-1H-pyrazol…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 118430-73-2 , [118430-73-2]
3-(tert-butyl)-1-methyl-1H-pyrazol-5-amine
5-amino-3-(tert-butyl)-1-methyl-1h-pyrazole
5-Amino-3-tert-butyl-1-methyl-1H-pyrazole
5-Amino-3-tert-butyl-1-methylpyrazole
5-Amino-3-tert-butyl-1-methylpyrazole, 98%
| 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) | 1.94 | 3.57 | -24.35 | 3 | 3 | 1 | 45 | 154.237 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 3.52 | -6.54 | 2 | 3 | 0 | 44 | 153.229 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 155-158? | Alfa-Aesar |
| Melting_Point | 155-158° | Alfa-Aesar |
| MP | 157-160° | Oakwood Chemical |
| MP | 157-160°C | Fluorochem |
| Mp [°C] | 86 - 88 | Acros Organics |
| Purity | 99% | Fluorochem |
| 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 |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | 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 |
| Hazard | XI: Irritant | Acros Organics |
