| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 2-methyl-4-phenyl-1H-imidazole 2-methyl-4-phenyl-1H-imidazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13739-48-5 , [13739-48-5]
| 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) | 1.69 | 5.55 | -9.25 | 1 | 2 | 0 | 29 | 158.204 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 5.94 | -32.55 | 2 | 2 | 1 | 30 | 159.212 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 5.53 | -6.88 | 1 | 2 | 0 | 29 | 158.204 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0993448A1; EP1042299A1; US5998424; US6020357; US6060491; WO1998028269A1; WO1998028282A2; WO1998057934A1; WO1998057937A2; WO1998057951A1; WO1999032454A1; WO1999050255A2 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | US6043254; WO1999051590A1 | IBM Patent Data |
