In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2005 | 14 | Yes |
Popular Name: methyl 1-adamantanecarboxylate methyl 1-adamantanecarboxylate
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CAS Numbers: 711-01-3 , [711-01-3]
Adamantane-1-carboxylic acid methyl ester
Methyl adamantane-1-carboxylate
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) | 3.11 | 1.85 | -4.24 | 0 | 2 | 0 | 26 | 194.274 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 37 | TCI |
BP | 79 / 1 | TCI |
Purity | 95% | Fluorochem |