| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: ethyl 3-(2-methyl-1H-imidazol-1-yl)propanoate ethyl 3-(2-methyl-1H-imidazol-1-…
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CAS Numbers: 18999-48-9 , [18999-48-9]
| 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) | 0.28 | 6.23 | -8.34 | 0 | 4 | 0 | 44 | 182.223 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 6.68 | -32 | 1 | 4 | 1 | 45 | 183.231 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 125°/0.4mm | Matrix Scientific |
| melting_point | 6.200000000000000e+001 | KeyOrganics KeyOrganics |
| MP | 62° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
