| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2008 | 11 | No |
Popular Name: 4-Fluorobenzamidoxime 4-Fluorobenzamidoxime
Find On: PubMed — Wikipedia — Google
CAS Numbers: 22179-78-8 , 69113-32-2
(Z)-4-Fluoro-N'-hydroxybenzimidamide
4-fluoro-N'-hydroxybenzenecarboximidamide
4-Fluoro-N'-hydroxybenzenecarboximidamide, 4-Fluoro-N'-hydroxybenzamidine
4-Fluoro-N'-hydroxybenzimidamide
4-Fluoro-N-hydroxy-benzamidine
benzenecarboximidamide, 4-fluoro-N'-hydroxy-
Benzenecarboximidamide, 4-fluoro-N-hydroxy-, (Z)- (9CI)
| 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) | 0.42 | 1.24 | -6.54 | 3 | 3 | 0 | 59 | 154.144 | 1 | ↓ |
| Ref Reference (pH 7) | 0.55 | 1.28 | -33.41 | 4 | 3 | 1 | 58 | 155.152 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.55 | 2.3 | -17.89 | 3 | 3 | 0 | 61 | 154.144 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.42 | 1.19 | -35.63 | 4 | 3 | 1 | 60 | 155.152 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.42 | 1.28 | -33.42 | 4 | 3 | 1 | 60 | 155.152 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 80 - 95 | Enamine Building Blocks |
| MP | 80...95 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| MP | 92-95° | Oakwood Chemical |
| purity | 95 | Enamine Building Blocks |
| Purity | 95%+ | Matrix Scientific |
| Mp [°C] | 95.2 - 96.1 | Acros Organics |
| Purity | 98% | Fluorochem |
| 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 |
No pre-computed analogs available. Try a structural similarity search.