In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2005 | 12 | Yes |
Popular Name: 6-Hydroxy-3,4-dihydronaphthalen-2(1H)-one 6-Hydroxy-3,4-dihydronaphthalen-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 52727-28-3 , [52727-28-3]
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) | 1.29 | 3.23 | -7.22 | 1 | 2 | 0 | 37 | 162.188 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95+% | Matrix Scientific |
Purity | 97% | Fluorochem |
PUBCHEM_PATENT_ID | EP0369734A2 | IBM Patent Data |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.