| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 15 | Yes |
Popular Name: Dimethyl 5-iodoisophthalate Dimethyl 5-iodoisophthalate
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CAS Number: 51839-15-7
| 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) | 3.29 | 2.64 | -7.19 | 0 | 4 | 0 | 52 | 320.082 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 105-107° | Matrix Scientific |
| BP | 160°/1mm | Oakwood Chemical |
| Purity | 98% | Matrix Scientific |
| Purity | >98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
