| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 12 | Yes |
Popular Name: 2,5-Dimethylphenylacetic acid 2,5-Dimethylphenylacetic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13612-34-5 , 6331-04-0 , [13612-34-5]
"2,5-Dimethylphenylacetic acid, 98%"
(2,5-dimethylphenyl)acetic acid
2,5-Dimethylphenyl acetic acid
2,5-Dimethylphenylacetic acid, 98%
2,5-Dimethylphenylacetic acid, 98+%
2-(2,5-dimethylphenyl)acetic acid
2-Methyl-5-(trifluoromethyl)phenylacetic acid, 96%
2-Methyl-5-(trifluoromethyl)phenylacetic acid, JRD
| 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) | 2.19 | 1.66 | -48.04 | 0 | 2 | -1 | 40 | 163.196 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 126-130? | Alfa-Aesar |
| Melting_Point | 126-130° | Alfa-Aesar |
| Mp [°C] | 128 - 132 | Acros Organics |
| MP | 129-130° | Oakwood Chemical |
| MP | 130 | TCI |
| Melting_Point | 68-70? | Alfa-Aesar |
| Melting_Point | 68-70° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| 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 |
| Hazard | XI: Irritant | Acros Organics |
