| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | Yes |
Popular Name: 6-Chlorooxindole 6-Chlorooxindole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 56341-37-8 , 563411-37-8 , [56341-37-8]
2H-Indol-2-one, 6-chloro-1,3-dihydro-
6-chloro-1,3-dihydro-2H-indol-2-one
6-Chloro-1,3-dihydro-indol-2-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) | 1.76 | 3.45 | -6.19 | 1 | 2 | 0 | 29 | 167.595 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 2.14 | -39.61 | 1 | 2 | -1 | 39 | 166.587 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 185 - 186 | KeyOrganics |
| Mp [°C] | 195 - 199 | Acros Organics |
| Melting_Point | 195-199? | Alfa-Aesar |
| Melting_Point | 195-199° | Alfa-Aesar |
| MP | 197 | TCI |
| MP | 49 - 51 | Enamine Building Blocks |
| MP | 49...51 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Fluorochem |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H315: Causes skin irritation; H317: May cause an allergic skin reaction; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| P phrase | P280: Wear eye protection/face protection | Acros Organics |
| P phrase | P280: Wear eye protection/face protection; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin.; R43: May cause sensitisation by skin contact. | Acros Organics |
| S phrase | S24: Avoid contact with skin. | Acros Organics |
| S phrase | S24: Avoid contact with skin.; 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 |
| PUBCHEM_PATENT_ID | US4242507 | IBM Patent Data |
| Hazard | XN: Harmful | Acros Organics |
