| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 2',4',6'-Trihydroxyacetophenone 2',4',6'-Trihydroxyacetophenone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 249278-28-2 , 480-66-0 , 67471-34-5 , [480-66-0]
"2',4',6'-Trihydroxyacetophenone monohydrate, 98%"
1-(2,4,6-Trihydroxyphenyl)-ethanone
1-(2,4,6-Trihydroxyphenyl)ethanone
2',4',6'-Trihydroxyacetophenone hydrate
2',4',6'-Trihydroxyacetophenone hydrate, 98+%
2',4',6'-Trihydroxyacetophenone monohydrate
2',4',6'-Trihydroxyacetophenone, 98%
2',4',6'-TRIHYDROXYACETOPHENONEMONOHYDRATE
2`,4`,6`-Trihydroxyacetophenone Monohydrate
ethanone, 1-(2,4,6-trihydroxyphenyl)-
| 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) | 1.19 | -3.38 | -9.94 | 3 | 4 | 0 | 78 | 168.148 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | -2.59 | -44.11 | 2 | 4 | -1 | 81 | 167.14 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 213-233° | Oakwood Chemical |
| MP | 215 | TCI |
| Melting_Point | 218-223? | Alfa-Aesar |
| Melting_Point | 218-223° | Alfa-Aesar |
| Mp [°C] | 219 - 222 | Acros Organics |
| MP | 219-221° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | 98% | APIChem |
| UniProt Database Links | CDC14_CAEEL; CTBP1_CAEEL; LI15B_CAEEL; LIN36_CAEEL; P52K_HUMAN; P52K_MOUSE; PELET_DROME; THA10_HUMAN; THA10_PONAB; THA11_BOVIN; THA11_DANRE; THA11_HUMAN; THA11_MOUSE; THA11_XENLA; THA11_XENTR; THAP1_BOVIN; THAP1_DANRE; THAP1_HUMAN; THAP1_MACFA; THAP1_MOUS | ChEBI |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H315: Causes skin irritation; 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 |
| 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 |
