| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 10 | Yes |
Popular Name: 4-Isopropylphenol 4-Isopropylphenol
| 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) | 2.97 | 3.56 | -3.31 | 1 | 1 | 0 | 20 | 136.194 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 109 / 10 | TCI |
| Boiling_Point | 211-212? | Alfa-Aesar |
| Boiling_Point | 211-212° | Alfa-Aesar |
| BP [°C] | 212 - 212.4 | Acros Organics |
| MP | 59 - 61 | Enamine Building Blocks |
| Mp [°C] | 59 - 62 | Acros Organics |
| Melting_Point | 59-61? | Alfa-Aesar |
| Melting_Point | 59-61° | Alfa-Aesar |
| MP | 59...61 | Enamine Building Blocks |
| MP | 61 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage | Acros Organics |
| P phrase | P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell | Acros Organics |
| P phrase | P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P280: Wear protecti | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R34: Causes burns. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.