UCSF

ZINC16697857

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 17 No

Popular Name: 4-(3,4-Difluorophenoxy)benzaldehyde 4-(3,4-Difluorophenoxy)benzaldehyde

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CAS Numbers: 486449-90-5 , [486449-90-5]

Other Names:

MFCD09038283

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) 3.74 7.27 -8.53 0 2 0 26 234.201 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0986540A1; WO1998047869A1 IBM Patent Data

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