| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | Yes |
Popular Name: 3,5-DIMETHYL-4-HYDROXYBENZONITRILE 3,5-DIMETHYL-4-HYDROXYBENZONITRILE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4198-90-7 , 695-53-4 , 876-15-3 , [4198-90-7]
3,5-dimethyl-4-hydroxy benzonitrile
3,5-Dimethyl-4-hydroxybenzonitrile, 97%
3,5-Dimethyl-4-hydroxybenzonitrile, 98%
3,5-Dimethyl-4-hydroxybenzonitrile; BRN 2574734; Benzonitrile, 3,5-dimethyl-4-hydroxy-; LS-38702
4-Hydroxy-3,5-dimethyl-benzonitrile
4-hydroxy-3,5-dimethylbenzonitrile
4-Hydroxy-3,5-dimethylbenzonitrile, 98%
4-HYDROXY-3,5-DIMETHYLBENZONITRILE; [4198-90-7]
| 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) | 2.23 | 1.44 | -5.64 | 1 | 2 | 0 | 44 | 147.177 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 123 - 126 | Acros Organics |
| M.P | 123-127 °C | Indofine |
| Melting_Point | 123-127? | Alfa-Aesar |
| Melting_Point | 123-127° | Alfa-Aesar |
| MP | 125 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| H phrase | H332: Harmful if inhaled | Acros Organics |
| H phrase | H332: Harmful if inhaled; H319: Causes serious eye irritation; H315: Causes skin irritation; H335: May cause respiratory irritation; H312: Harmful in contact with skin; H302: Harmful if swallowed | Acros Organics |
| Warnings | IRRITANT | 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 | S22: Do not breathe dust. | Acros Organics |
| S phrase | S22: Do not breathe dust.; 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 |
| Purity | ¡Ý99% | APIChem |
