| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 15 | Yes |
Popular Name: 3,3-Dimethyl-pentanedioicacid mono-tert-butylester 3,3-Dimethyl-pentanedioicacid mo…
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CAS Number: 114359-46-5
3,3-Dimethyl-pentanedioic acid mono-tert-butyl ester
| 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) | 2.00 | 7.09 | -44.91 | 0 | 4 | -1 | 66 | 215.269 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 5.11 | -8.78 | 1 | 4 | 0 | 64 | 216.277 | 6 | ↓ |
