UCSF

ZINC00153737

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 20 No

Popular Name: 4-((4-Fluorobenzyl)oxy)-3-nitrobenzaldehyde 4-((4-Fluorobenzyl)oxy)-3-nitrob…

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CAS Numbers: 175136-18-2 , [175136-18-2]

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) 3.43 3.52 -20.66 0 5 0 72 275.235 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity >95% Matrix Scientific
PUBCHEM_PATENT_ID EP0735031A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

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