| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 16 | No |
Popular Name: 4-Hydroxy-5-methoxy-2-nitro-benzoic acid methyl ester 4-Hydroxy-5-methoxy-2-nitro-benz…
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CAS Number: 27883-60-9
4-Hydroxy-5-methoxy-2-nitro-benzoic acid methylester
4-hydroxy-5-methoxy-2-nitro-benzoicacidmethylester
HYDROXYMETHOXYNITROBENZOICACIDMETHYLESTE
| 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) | 1.52 | 3.29 | -15.49 | 1 | 7 | 0 | 102 | 227.172 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 4.24 | -40.66 | 0 | 7 | -1 | 104 | 226.164 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 90% | Fluorochem |
| Purity | 90%+ | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
