| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 5 | No |
Popular Name: (1Z)-N'-hydroxyethanimidamide (1Z)-N'-hydroxyethanimidamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 22059-22-9 , 5426-04-0 , [22059-22-9]
ethanimidamide, N'-hydroxy-, (1E)-, monohydrochloride
HYDROXYETHANIMIDAMIDEHYDROCHLORIDE N-'
| 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) | -0.29 | -1.74 | -5.88 | 3 | 3 | 0 | 59 | 74.083 | 0 | ↓ |
| Lo Low (pH 4.5-6) | -0.29 | -1.88 | -30.46 | 4 | 3 | 1 | 60 | 75.091 | 0 | ↓ |
| Lo Low (pH 4.5-6) | -0.29 | -1.8 | -30.59 | 4 | 3 | 1 | 60 | 75.091 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 118 - 120 | Enamine Building Blocks |
| MP | 118...120 | Enamine Building Blocks |
| Mp [°C] | 134 - 138 | Acros Organics |
| MP | 134-136° | Oakwood Chemical |
| MP | 138 - 140 | Enamine Building Blocks |
| MP | 138...140 | Enamine Building Blocks |
| MP | 139 - 141 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H315: Causes skin 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 |
No pre-computed analogs available. Try a structural similarity search.