| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 10 | Yes |
Popular Name: 2,5-Difluorobenzonitrile 2,5-Difluorobenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 64248-64-2 , [64248-64-2]
2,5-Difluorobenzonitrile [64248-64-2]
2,5-Difluorobenzonitrile, 98+%
| 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 | 4.98 | -5.75 | 0 | 1 | 0 | 24 | 139.104 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 188? | Alfa-Aesar |
| Boiling_Point | 188° | Alfa-Aesar |
| Melting_Point | 31-35? | Alfa-Aesar |
| Melting_Point | 31-35° | Alfa-Aesar |
| Mp [°C] | 33 - 35 | Acros Organics |
| MP | 33-35° | Matrix Scientific |
| MP | 33...35 | Enamine Building Blocks |
| MP | 34 - 35 | Enamine Building Blocks |
| MP | 35 - 35 | Enamine Building Blocks |
| MP | 35 - 37 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| BP | 92 / 30 | TCI |
| purity | 95 | Enamine Building Blocks |
| Purity | 98% | Matrix Scientific |
| Purity | 99% | Fluorochem |
| H phrase | H312: Harmful in contact with skin | Acros Organics |
| H phrase | H312: Harmful in contact with skin; H335: May cause respiratory irritation; H319: Causes serious eye irritation; H302: Harmful if swallowed; H332: Harmful if inhaled; H315: Causes skin irritation | Acros Organics |
| Warnings | IRRITANT, IRRITANT-HARMFUL | Matrix Scientific |
| Warnings | Irritant/Irritant-Harmful | Matrix Scientific |
| 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; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/p | 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.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | 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. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
