In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 14 | No |
Popular Name: 5-Nitro-2H-benzo[b][1,4]oxazin-3(4H)-one 5-Nitro-2H-benzo[b][1,4]oxazin-3…
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CAS Numbers: 132522-81-7 , [132522-81-7]
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) | 0.90 | 2.69 | -12.01 | 1 | 6 | 0 | 84 | 194.146 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 117-119° | Matrix Scientific |
Purity | 97% | Fluorochem |
Purity | >97% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |