UCSF

ZINC02567820

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 2-Bromo-5-chloroaniline 2-Bromo-5-chloroaniline

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CAS Numbers: 774608-49-0 , 823-57-4 , [823-57-4]

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) 2.84 3.6 -1.99 2 1 0 26 206.47 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 127-128°/7mm Oakwood Chemical
BP 128 / 7 TCI
MP 37-40° Oakwood Chemical
MP 38 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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