| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 13 | Yes |
Popular Name: N,N'-Bis(3-aminopropyl)-1,3-propanediamine N,N'-Bis(3-aminopropyl)-1,3-prop…
Find On: PubMed — Wikipedia — Google
CAS Number: 4605-14-5
| 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) | -2.40 | -0.65 | -273.92 | 10 | 4 | 4 | 88 | 192.351 | 10 | ↓ |
| Mid Mid (pH 6-8) | -2.40 | -1.03 | -185.71 | 9 | 4 | 3 | 87 | 191.343 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 101-103?/1mm | Alfa-Aesar |
| Boiling_Point | 101-103°/1mm | Alfa-Aesar |
| BP [°C] | 102 (p=1 torr) | Acros Organics |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| H phrase | H318: Causes serious eye damage | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; 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, | Acros Organics |
| UniProt Database Links | PAO1_ARATH; SPEE_THEMA; SPEE_THET8 | ChEBI |
| R phrase | R34: Causes burns. | Acros Organics |
| S phrase | S25: Avoid contact with eyes. | Acros Organics |
| S phrase | S25: Avoid contact with eyes.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible). | Acros Organics |
| Patent Database Links | US2007190182 | ChEBI |
