UCSF

ZINC02584336

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 11 Yes

Popular Name: 1,4-Dimethoxy-2-fluorobenzene 1,4-Dimethoxy-2-fluorobenzene

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CAS Numbers: 82830-49-7 , [82830-49-7]

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) 2.14 1.96 -6.37 0 2 0 18 156.156 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 119-121?/40mm Alfa-Aesar
Boiling_Point 119-121°/40mm Alfa-Aesar
BP 121 / 40 TCI
Melting_Point 23-26? Alfa-Aesar
Melting_Point 23-26° Alfa-Aesar
Purity 98% Fluorochem

Activity (Go SEA)

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