In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 18 | Yes |
Popular Name: 3-oxo-3H-benzo[f]chromene-2-carboxylic acid 3-oxo-3H-benzo[f]chromene-2-carb…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4361-00-6 , [4361-00-6]
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) | 2.67 | 8.94 | -60.95 | 0 | 4 | -1 | 70 | 239.206 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 236 - 239 | KeyOrganics |
MP | 236-237° | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |