| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 10 | Yes |
Popular Name: 2-Methylindoline 2-Methylindoline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 22160-09-4 , 6872-06-6 , 6872/6/6
| 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) | 2.12 | -0.88 | -2.94 | 1 | 1 | 0 | 12 | 133.194 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 51 | Acros Organics |
| BP [°C] | 227 (p=759.75 torr) | Acros Organics |
| BP | 230 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| H phrase | H412: Harmful to aquatic life with long lasting effects | Acros Organics |
| H phrase | H412: Harmful to aquatic life with long lasting effects; H302: Harmful if swallowed | Acros Organics |
| P phrase | P273: Avoid release to the environment | Acros Organics |
| P phrase | P273: Avoid release to the environment; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | Acros Organics |
| S phrase | S57: Use appropriate container to avoid environmental contamination. | Acros Organics |
| S phrase | S57: Use appropriate container to avoid environmental contamination.; S60: This material and its container must be disposed of as hazardous waste. | Acros Organics |
| PUBCHEM_PATENT_ID | US4115413 | IBM Patent Data |
| Hazard | XN: Harmful | Acros Organics |
