In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2005 | 14 | Yes |
Popular Name: 1,2-Dimethylindole-3-carboxylic acid 1,2-Dimethylindole-3-carboxylic …
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CAS Numbers: 20357-15-7 , 21150-73-2 , [20357-15-7]
1,2-dimethyl-1H-indole-3-carboxylic acid
1,2-dimethyl-1h-indole-3-carboxylicacid
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) | 1.95 | 6.36 | -62.52 | 0 | 3 | -1 | 45 | 188.206 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 200-202° (dec.) | Fluorochem |
MP | 200-202°(dec) | Matrix Scientific |
melting_point | 210 - 211 | KeyOrganics |
MP | 214-216° | Oakwood Chemical |
Purity | 95%+ | Fluorochem |
Purity | 98% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |