| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 17th, 2008 | 18 | Yes |
Popular Name: 3-[(3,3-Dimethylbutanoyl)amino]-4-methylbenzoic acid 3-[(3,3-Dimethylbutanoyl)amino]-…
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CAS Numbers: 915921-64-1 , [915921-64-1]
3-(3,3-Dimethylbutanamido)-4-methylbenzoic acid
3-[(3,3-dimethylbutanoyl)amino]-4-methylbenzoicacid
| 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 | 7.53 | -63.4 | 1 | 4 | -1 | 69 | 248.302 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
