| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 9 | Yes |
Popular Name: 2,6-Difluorophenol 2,6-Difluorophenol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 28177-48-2 , [28177-48-2]
| 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) | 1.95 | 1.78 | -5.91 | 1 | 1 | 0 | 20 | 130.093 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 36-40? | Alfa-Aesar |
| Melting_Point | 36-40° | Alfa-Aesar |
| MP | 38 - 41 | Enamine Building Blocks |
| Mp [°C] | 38 - 42 | Acros Organics |
| MP | 38-41° | Matrix Scientific |
| MP | 38...41 | Enamine Building Blocks |
| MP | 45 | TCI |
| BP [°C] | 59 - 61 (p=17 torr) | Acros Organics |
| Boiling_Point | 59-61?/17mm | Alfa-Aesar |
| BP | 59-61° | Oakwood Chemical |
| Boiling_Point | 59-61°/17mm | Alfa-Aesar |
| BP | 60 / 17.3 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Matrix Scientific |
| Hazard | F: Highly flammable | Acros Organics |
| Hazard | F: Highly flammable; C: Corrosive | Acros Organics |
| Warnings | FLAMMABLE, CORROSIVE | Matrix Scientific |
| Warnings | Flammable/Corrosive | Matrix Scientific |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage; H312: Harmful in contact with skin; H332: Harmful if inhaled; H228: Flammable solid | 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; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P310: Immediately call a POISON CEN | Acros Organics |
| R phrase | R11: Highly flammable. | Acros Organics |
| R phrase | R11: Highly flammable.; R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; 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 |
No pre-computed analogs available. Try a structural similarity search.