UCSF

ZINC02574964

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Substance Information

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

Popular Name: 4-Bromo-2,6-difluoroanisole 4-Bromo-2,6-difluoroanisole

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CAS Numbers: 104197-14-0 , [104197-14-0]

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) 2.99 2.09 -2.93 0 1 0 9 223.016 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 100 / 15 TCI
Boiling_Point 100?/15mm Alfa-Aesar
Boiling_Point 100°/15mm Alfa-Aesar
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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Rings

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