UCSF

ZINC09428924

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 26th, 2007 13 No

Popular Name: Methyl alpha-bromo-2-chlorophenylacetate Methyl alpha-bromo-2-chloropheny…

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CAS Numbers: 115871-49-3 , 141109-25-3 , 85259-19-4 , [85259-19-4]

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) 3.12 1.63 -5.06 0 2 0 26 263.518 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 27 - 29 Enamine Building Blocks
MP 27...29 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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

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