| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 7th, 2006 | 7 | Yes |
Popular Name: 2-Ethylimidazole 2-Ethylimidazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1072-62-4 , [1072-62-4]
| 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) | 0.62 | 2.09 | -8.11 | 0 | 2 | 0 | 26 | 94.117 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 3.08 | -28.02 | 2 | 2 | 1 | 30 | 97.141 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 2.62 | -6.45 | 1 | 2 | 0 | 29 | 96.133 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 268 | Acros Organics |
| Boiling_Point | 268? | Alfa-Aesar |
| BP | 268° | Fluorochem |
| Melting_Point | 78-86? | Alfa-Aesar |
| Melting_Point | 78-86° | Alfa-Aesar |
| MP | 78° | Fluorochem |
| MP | 83 | TCI |
| Mp [°C] | 83 - 87 | Acros Organics |
| Purity | 97% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0803135A1; EP0803135B1; EP0969706A2; US5216007; US5590460; WO1996002959A1 | IBM Patent Data |
| H phrase | H318: Causes serious eye damage | Acros Organics |
| H phrase | H318: Causes serious eye damage; H315: Causes skin irritation; H302: Harmful if swallowed | Acros Organics |
| P phrase | P280: Wear eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P310: Immediately call a | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R38: Irritating to skin.; R41: Risk of serious damage to eyes. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.