| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 21 | No |
Popular Name: 1-[(4-methylphenyl)sulfonyl]-1H-indole-3-carbaldehyde 1-[(4-methylphenyl)sulfonyl]-1H-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 50562-79-3 , [50562-79-3]
1-(4-Methylbenzenesulfonyl)-1H-indole-3-carboxaldehyde
1-(Toluene-4-sulfonyl)-1 H -indole-3-carbaldehyde
1-(Toluene-4-sulfonyl)-1H-indole-3-carbaldehyde
1-Tosyl-1H-indole-3-carbaldehyde
1H-Indole-3-carboxaldehyde,1-[(4-methylphenyl)sulfonyl]-
| 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) | 3.30 | 7.05 | -12.92 | 0 | 4 | 0 | 56 | 299.351 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 136 - 139 | KeyOrganics |
| MP | 136-139° | Matrix Scientific |
| Mp [°C] | 138 - 140 | Acros Organics |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
