| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 8 | No |
Popular Name: 1-Aminoheptane 1-Aminoheptane
Find On: PubMed — Wikipedia — Google
CAS Numbers: 111-68-2 , [111-68-2]
| 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) | 2.07 | 3.42 | -39.73 | 3 | 1 | 1 | 28 | 116.228 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 23 | Acros Organics |
| Melting_Point | 23? | Alfa-Aesar |
| Melting_Point | 23° | Alfa-Aesar |
| BP [°C] | 153 - 156 | Acros Organics |
| Boiling_Point | 154-156? | Alfa-Aesar |
| Boiling_Point | 154-156° | Alfa-Aesar |
| Hazard | C: Corrosive | Acros Organics |
| PUBCHEM_PATENT_ID | EP0507145A1; EP0507145B1; EP0747383A2; EP0747383A3; EP0801069A1; EP0804441A1; EP0806426A1; EP0846679B1; US4207263; US4565690; US4962129; US5478706; US5847027; US5902899; US5925768; US5977286; WO1993025557A1; WO1996022296A1; WO1998045300A1 | IBM Patent Data |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage; H226: Flammable liquid and vapor | 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 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 r | Acros Organics |
| R phrase | R10: Flammable. | Acros Organics |
| R phrase | R10: Flammable.; R34: Causes burns. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accid | Acros Organics |
| PUBCHEM_PATENT_ID | US4962129 | IBM Patent Data |
