In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 16 | Yes |
Popular Name: 2,4,6-Trimethoxy-benzoic acid methyl ester 2,4,6-Trimethoxy-benzoic acid me…
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CAS Number: 29723-28-2
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) | 1.80 | 3.2 | -11.83 | 0 | 5 | 0 | 54 | 226.228 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0997463A1 | IBM Patent Data |