UCSF

ZINC02584262

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 9 Yes

Popular Name: 3-CHLORO-2-FLUOROTOLUENE 3-CHLORO-2-FLUOROTOLUENE

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CAS Numbers: 85089-31-2 , [85089-31-2]

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) 3.13 5.7 -3.95 0 0 0 0 144.576 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
SOLUBILITY Soluble in most organic solvents Indofine

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.