UCSF

ZINC02243118

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2004 9 Yes

Popular Name: 5-Bromo-2-fluoroaniline 5-Bromo-2-fluoroaniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1052403-50-5 , 2724-09-6 , 2924-09-6 , 2924-9-6 , 9/6/2924 12:00:00 AM , [2924-09-6] , [60811-17-8]

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) 2.32 -0.85 -2.4 2 1 0 26 190.015 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 105 / 12 TCI
Boiling_Point 105?/12mm Alfa-Aesar
BP 105°/12mm Matrix Scientific
Melting_Point 27? Alfa-Aesar
MP 27° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Matrix Scientific
Warnings IRRITANT, TOXIC Matrix Scientific
Warnings Toxic/Irritant Matrix Scientific

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

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