In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 24 | No |
Popular Name: 4-(4-benzylpiperazino)-3-nitrobenzenecarbaldehyde 4-(4-benzylpiperazino)-3-nitrobe…
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CAS Numbers: 301193-53-3 , N/A
4-(4-benzylpiperazin-1-yl)-3-nitrobenzaldehyde
4-(4-Benzylpiperazino)-3-nitrobenzenecarboxaldehyde
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) | 3.01 | 9.49 | -9.03 | 0 | 6 | 0 | 69 | 325.368 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 104 - 106 | KeyOrganics |
MP | 99-101° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |