| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 4-(1H-pyrazol-1-yl)aniline 4-(1H-pyrazol-1-yl)aniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17635-45-9 , 913848-94-9 , [17635-45-9]
4-(1H-pyrazol-1-yl)aniline hydrochloride
benzenamine, 4-(1H-pyrazol-1-yl)-, hydrochloride
| 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) | 0.74 | 3.56 | -7.76 | 2 | 3 | 0 | 44 | 159.192 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 42-44° | Oakwood Chemical |
| Mp [°C] | 54 - 55 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Matrix Scientific |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| 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 |
| Hazard | XI: Irritant | Acros Organics |
