| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 13 | Yes |
Popular Name: 2',4'-Dimethoxyacetophenone 2',4'-Dimethoxyacetophenone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1201-38-3 , 829-20-9 , [829-20-9]
1-(2,4-dimethoxyphenyl)ethan-1-one
1-(2,4-Dimethoxyphenyl)ethanone
| 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) | 1.88 | 4.81 | -10.83 | 0 | 3 | 0 | 36 | 180.203 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 287-289? | Alfa-Aesar |
| Boiling_Point | 287-289° | Alfa-Aesar |
| BP [°C] | 288 | Acros Organics |
| BP | 288° | Matrix Scientific |
| BP | 297 | TCI |
| Mp [°C] | 38 - 42 | Acros Organics |
| MP | 39 - 41 | Enamine Building Blocks |
| Melting_Point | 39-41? | Alfa-Aesar |
| Melting_Point | 39-41° | Alfa-Aesar |
| MP | 39...41 | Enamine Building Blocks |
| MP | 40 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| Purity | 99% | APIChem |
| Warnings | IRRITANT | Matrix Scientific |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.