UCSF

ZINC00156989

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: 2-Fluoro-6-phenoxybenzonitrile 2-Fluoro-6-phenoxybenzonitrile

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CAS Numbers: 175204-06-5 , [175204-06-5]

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) 3.51 3.91 -10.3 0 2 0 33 213.211 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 90-93? Alfa-Aesar
Melting_Point 90-93° Alfa-Aesar
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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