UCSF

ZINC00155598

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: 2',4'-Dihydroxypropiophenone 2',4'-Dihydroxypropiophenone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 5792-36-9 , [5792-36-9]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 1.78 1.46 -9.59 2 3 0 58 166.176 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 101 TCI
BP 178 / 7 TCI
MP 95-98 °C(lit.) Indofine
MP 95-98o C Indofine
Melting_Point 98-101? Alfa-Aesar
Melting_Point 98-101° Alfa-Aesar
SOLUBILITY Soluble in Acetone or methanol Indofine

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )