In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2004 | 25 | Yes |
Popular Name: 2,4-BIS(ALPHA,ALPHA-DIMETHYLBENZYL)PHENOL 2,4-BIS(ALPHA,ALPHA-DIMETHYLBENZ…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 2772-45-4 , 80-43-3 , [2772-45-4]
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) | 6.63 | 2.56 | -4.81 | 1 | 1 | 0 | 20 | 330.471 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 221 / 10 | TCI |
MP | 65 | TCI |
PUBCHEM_PATENT_ID | EP0259530B1; EP0380839A1; EP0380840A1; EP0380840B1; EP0389423A1; EP0389423B1; EP0406828B1; EP0412840A2; EP0412840A3; EP0522454A1; EP0566295A3; US5859098 | IBM Patent Data |