UCSF

ZINC00153736

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 No

Popular Name: 4-(4-Fluorobenzyloxy)benzaldehyde 4-(4-Fluorobenzyloxy)benzaldehyde

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CAS Numbers: 56442-17-2 , [56442-17-2]

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) 3.54 2.54 -9.7 0 2 0 26 230.238 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 100 - 102 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Mp [°C] 96 - 100 Acros Organics
MP 98 - 100 Enamine Building Blocks
MP 98...100 Enamine Building Blocks
MP 99 - 100 Enamine Building Blocks
MP 99-100° Matrix Scientific
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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