| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2005 | 8 | Yes |
Popular Name: (5-methyl-3-isoxazolyl)methylamine (5-methyl-3-isoxazolyl)methylamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1050590-34-5 , 1247734-80-0 , 154016-48-5 , [154016-48-5]
(5-methyl-1,2-oxazol-3-yl)methanamine
(5-Methyl-3-isoxazolyi)methylamine
(5-Methylisoxazol-3-yl)methanamine
(5-Methylisoxazol-3-yl)methanamine hydrochloride
(5-Methylisoxazol-3-yl)methylamine
(5-Methylisoxazol-3-yl)methylamine hydrochloride
1-(5-methylisoxazol-3-yl)methanamine
1-(5-methylisoxazol-3-yl)methanamine hydrobromide
3-(aminomethyl)-5-methylisoxazole
3-(Aminomethyl)-5-methylisoxazole hydrochloride
3-Isoxazolemethanamine, 5-methyl-
3-isoxazolemethanamine, 5-methyl-, monohydrochloride
| 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) | 0.07 | 0.67 | -43.28 | 3 | 3 | 1 | 54 | 113.14 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 75 - 76 (p=0.4 torr) | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
| R phrase | R34: Causes burns. | 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.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.