UCSF

ZINC03886330

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 15 No

Popular Name: 3-Bromo-4,5-diethoxybenzaldehyde 3-Bromo-4,5-diethoxybenzaldehyde

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CAS Numbers: 90109-64-1 , [90109-64-1]

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) 3.06 1.4 -7.61 0 3 0 35 273.126 5 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
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.