| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 12 | Yes |
Popular Name: 5-Fluoroisatin 5-Fluoroisatin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 443-69-6 , [443-69-6]
5-fluoro-2,3-dihydro-1H-indole-2,3-dione
5-fluoro-2-hydroxy-3H-indol-3-one
| 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) | 0.00 | 2.05 | -9.35 | 1 | 3 | 0 | 50 | 165.123 | 0 | ↓ |
| Ref Reference (pH 7) | 0.45 | -0.71 | -6.35 | 1 | 3 | 0 | 50 | 165.123 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 0.08 | -40.04 | 0 | 3 | -1 | 53 | 164.115 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 224 - 227 | Enamine Building Blocks |
| Mp [°C] | 224 - 228 | Acros Organics |
| Melting_Point | 224-227? | Alfa-Aesar |
| MP | 224-227° | Matrix Scientific |
| MP | 224...227 | Enamine Building Blocks |
| MP | 227 | TCI |
| mp | 245231 | MolMall (formerly Molecular Diversity Preservation International) |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Purity | 99% | APIChem |
| 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 |
