In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 11 | No |
Popular Name: Benzoyl chloride, 4-ethynyl- (9CI) Benzoyl chloride, 4-ethynyl- (9CI)
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CAS Number: 62480-31-3
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) | 2.15 | 5.93 | -4.65 | 0 | 1 | 0 | 17 | 164.591 | 1 | ↓ |