| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 14 | Yes |
Popular Name: 3,5-Dimethoxy-4-hydroxyphenyl acetonitrile 3,5-Dimethoxy-4-hydroxyphenyl ac…
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CAS Numbers: 42973-55-7 , [42973-55-7]
| 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) | 1.26 | 2.67 | -13.86 | 1 | 4 | 0 | 62 | 193.202 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 68-70° | Matrix Scientific |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT, IRRITANT-HARMFUL | Matrix Scientific |
| Warnings | Irritant/Irritant-Harmful | Matrix Scientific |
