| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 11 | Yes |
Popular Name: 2-Hydroxy-4-methylbenzoic acid 2-Hydroxy-4-methylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 50-85-1 , 866913-15-7 , [50-85-1] , [50512-48-6]
2-Hydroxy-4-methylbenzoic acid; 4-Methylsalicylate; 50-85-1; C14103; m-Cresotic acid
4-Methylacrylamidesalicylic acid
| 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) | 2.30 | -0.32 | -53.29 | 1 | 3 | -1 | 60 | 151.141 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 173 - 177 | Enamine Building Blocks |
| MP | 173-177° | Fluorochem |
| MP | 173...177 | Enamine Building Blocks |
| Mp [°C] | 175 - 179 | Acros Organics |
| Melting_Point | 176-180? | Alfa-Aesar |
| Melting_Point | 176-180° | Alfa-Aesar |
| MP | 177 | TCI |
| MP | 177 - 179 | Enamine Building Blocks |
| MP | 177-180° | Oakwood Chemical |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Purity | 99% | APIChem |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H319: Causes serious eye irritation; H315: Causes skin 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 |
| PUBCHEM_PATENT_ID | WO2000059874A1 | IBM Patent Data |
| Hazard | XI: Irritant | Acros Organics |
