| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 10 | Yes |
Popular Name: 3'-Hydroxyacetophenone 3'-Hydroxyacetophenone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 118-93-4 , 121-71-1 , [121-71-1]
| 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) | 1.33 | 2.04 | -9.21 | 1 | 2 | 0 | 37 | 136.15 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 153 / 5 | TCI |
| BP [°C] | 296 | Acros Organics |
| Boiling_Point | 296? | Alfa-Aesar |
| Boiling_Point | 296° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| M.P | 90-95 °C | Indofine |
| MP | 90-95° | Oakwood Chemical |
| Melting_Point | 93-97? | Alfa-Aesar |
| Melting_Point | 93-97° | Alfa-Aesar |
| MP | 94 | TCI |
| Mp [°C] | 94 - 97 | Acros Organics |
| purity | 95 | Enamine Building Blocks |
| MP | 95 - 97 | Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| MP | 95...97 | Enamine Building Blocks |
| Purity | 97% | APIChem |
| Purity | 98% | Fluorochem |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye 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; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rins | Acros Organics |
| R phrase | R22: Harmful if swallowed. | 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 |
| Hazard | XN: Harmful | Acros Organics |
