| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | No |
Popular Name: 2-Methyl-5-nitrophenol 2-Methyl-5-nitrophenol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5248-54-6 , 5428-54-6 , [5428-54-6]
| 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) | 2.26 | 0.16 | -7.69 | 1 | 4 | 0 | 66 | 153.137 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 111-115° | Oakwood Chemical |
| MP | 113 - 115 | Enamine Building Blocks |
| MP | 113...115 | Enamine Building Blocks |
| MP | 114 - 115 | Enamine Building Blocks |
| MP | 115 - 115 | Enamine Building Blocks |
| MP | 115 - 117 | Enamine Building Blocks |
| Melting_Point | 116-120? | Alfa-Aesar |
| Melting_Point | 116-120° | Alfa-Aesar |
| MP | 120 | TCI |
| BP | 180 / 15 | TCI |
| Boiling_Point | 180?/15mm | Alfa-Aesar |
| Boiling_Point | 180°/15mm | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Purity | 98%min | APIChem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | 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.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Warnings | Toxic | Matrix Scientific |
| Hazard | XI: Irritant | Acros Organics |
