In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 10 | No |
Popular Name: 1,3-Dioxolane-4-carboxaldehyde, 2,2,4-trimethyl- (9CI) 1,3-Dioxolane-4-carboxaldehyde, …
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CAS Number: 81600-36-4
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) | 1.19 | 2.13 | -4.76 | 0 | 3 | 0 | 36 | 144.17 | 1 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4153614; US4201879; US4234490 | IBM Patent Data |