| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 16 | Yes |
Popular Name: 5-(4-methoxyphenyl)-2-thiophenecarboxylic acid 5-(4-methoxyphenyl)-2-thiophenec…
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CAS Numbers: 116016-56-9 , [116016-56-9]
5-(4-Methoxyphenyl)-2-thiophenecarboxylicacid
5-(4-Methoxyphenyl)thiophene-2-carboxylic acid
| 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) | 3.38 | 0.19 | -51.84 | 0 | 3 | -1 | 49 | 233.268 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 9.29 | -10.67 | 2 | 4 | 0 | 54 | 372.346 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 202 - 204 | KeyOrganics |
| MP | 202-204° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
