UCSF

ZINC12359152

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 11 No

Popular Name: 3,5-Difluoro-4-hydroxybenzaldehyde 3,5-Difluoro-4-hydroxybenzaldehyde

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CAS Numbers: 118276-06-5 , [118276-06-5]

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) 1.69 1.54 -8.96 1 2 0 37 158.103 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 121 - 123 Enamine Building Blocks
Melting_Point 121-124? Alfa-Aesar
Melting_Point 121-124° Alfa-Aesar
MP 121...123 Enamine Building Blocks
MP 122-124° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem

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