| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | Yes |
Popular Name: 1-(3,4,5-Trimethoxyphenyl)ethanone 1-(3,4,5-Trimethoxyphenyl)ethanone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1136-86-3 , [1136-86-3]
1-(3,4,5-trimethoxyphenyl)ethan-1-one
3',4',5'-Trimethoxyacetophenone
3',4',5'-Trimethoxyacetophenone, 99%
3,4,5-Trimethoxyacetophenone; bmse010088
3’,4’,5’-Trimethoxyacetophenone
| 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) | 1.47 | 4.03 | -9.93 | 0 | 4 | 0 | 45 | 210.229 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 173-174?/10mm | Alfa-Aesar |
| Boiling_Point | 173-174°/10mm | Alfa-Aesar |
| BP | 224 / 40 | TCI |
| MP | 79 - 81 | Enamine Building Blocks |
| Melting_Point | 79-83? | Alfa-Aesar |
| Melting_Point | 79-83° | Alfa-Aesar |
| MP | 79...81 | Enamine Building Blocks |
| MP | 82 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
