| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 8 | Yes |
Popular Name: 3-Chlorophenol 3-Chlorophenol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 108-43-0 , [108-43-0]
| 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) | 2.11 | 2.15 | -3.66 | 1 | 1 | 0 | 20 | 128.558 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 1.46e+01 g/l | DrugBank-experimental |
| BP [°C] | 214 | Acros Organics |
| Boiling_Point | 214? | Alfa-Aesar |
| Boiling_Point | 214° | Alfa-Aesar |
| Melting_Point | 30-34? | Alfa-Aesar |
| Melting_Point | 30-34° | Alfa-Aesar |
| Mp [°C] | 33 - 35 | Acros Organics |
| Purity | 98% | Fluorochem |
| Patent Database Links | EP1508601 | ChEBI |
| H phrase | H312: Harmful in contact with skin | Acros Organics |
| H phrase | H312: Harmful in contact with skin; H332: Harmful if inhaled; H411: Toxic to aquatic life with long lasting effects; H302: Harmful if swallowed | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P273: Avoid release to the environment; P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | Acros Organics |
| S phrase | S28A: After contact with skin, wash immediately with plenty of water. | Acros Organics |
| S phrase | S28A: After contact with skin, wash immediately with plenty of water.; S61: Avoid release to the environment. Refer to special instructions / safety data sheets. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
| Hazard | XN: Harmful; N: Dangerous for the environment | Acros Organics |
