In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2004 | 9 | Yes |
Popular Name: 3-Methylisoxazole-4-carboxylic acid 3-Methylisoxazole-4-carboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17153-20-7 , [17153-20-7]
3-methyl-4-isoxazolecarboxylic acid
3-methyl-4-isoxazolecarboxylicacid
3-methyl-isoxazole-4-carboxylic acid
3-Methylisoxazole-4-carboxylic acid, 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) | 0.14 | 2.17 | -42.18 | 0 | 4 | -1 | 66 | 126.091 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 183 - 190 | Acros Organics |
Melting_Point | 185-187? | Alfa-Aesar |
Melting_Point | 185-187° | Alfa-Aesar |
Purity | 95+% | Matrix Scientific |
Purity | 97% | Fluorochem |
H phrase | H319: Causes serious eye irritation | Acros Organics |
H phrase | H319: Causes serious eye irritation; H335: May cause respiratory 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 | 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 | XI: Irritant | Acros Organics |