In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 21 | No |
Popular Name: 6,6-bis(ethoxycarbonyl)-3,4-dimethyl-3-cyclohexene-1-carboxylic acid 6,6-bis(ethoxycarbonyl)-3,4-dime…
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CAS Number: 477862-70-7
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) | 2.49 | 3.77 | -54.75 | 0 | 6 | -1 | 92 | 297.327 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 85 - 87 | KeyOrganics |