| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 25 | Yes |
Popular Name: ethyl 1,4-dibenzylpiperazine-2-carboxylate ethyl 1,4-dibenzylpiperazine-2-c…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 72351-59-8 , [72351-59-8]
None
| 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) | 3.26 | 10.65 | -34.27 | 1 | 4 | 1 | 34 | 339.459 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.26 | 8.45 | -5.88 | 0 | 4 | 0 | 33 | 338.451 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.26 | 10.78 | -39.68 | 1 | 4 | 1 | 34 | 339.459 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 200 - 202 (p=0.5 torr) | Acros Organics |
| Purity | 97% | Fluorochem |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H315: Causes skin irritation; H335: May cause respiratory irritation | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
