| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 9 | Yes |
Popular Name: 4-(Methylmercapto)phenol 4-(Methylmercapto)phenol
Find On: PubMed — Wikipedia — Google
CAS Number: 1073-72-9
| 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) | 1.89 | 2.65 | -4.32 | 1 | 1 | 0 | 20 | 140.207 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 153 - 156 (p=20 torr) | Acros Organics |
| Boiling_Point | 153-156?/20mm | Alfa-Aesar |
| Boiling_Point | 153-156°/20mm | Alfa-Aesar |
| BP | 154 / 19 | TCI |
| MP | 84-86° | Oakwood Chemical |
| Mp [°C] | 85 - 87 | Acros Organics |
| Melting_Point | 85-87? | Alfa-Aesar |
| Melting_Point | 85-87° | Alfa-Aesar |
| MP | 86 | TCI |
| MP | 86 - 88 | Enamine Building Blocks |
| MP | 86...88 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | APIChem |
| Purity | 99% | Fluorochem |
| H phrase | H312: Harmful in contact with skin | Acros Organics |
| H phrase | H312: Harmful in contact with skin; H332: Harmful if inhaled | 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; P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P340: IF INHALED: Remove to fresh air and keep at r | Acros Organics |
| R phrase | R20/21: Harmful by inhalation and in contact with skin. | Acros Organics |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
