UCSF

ZINC01595133

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 11 No

Popular Name: 4-Fluorophenylglyoxal hydrate 4-Fluorophenylglyoxal hydrate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 403-32-7 , 447-43-8 , 7468-86-2 , [447-43-8]

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) 1.44 5.2 -11.85 0 2 0 34 152.124 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 115°/35mm Matrix Scientific
MP 80-82° Matrix Scientific
Melting_Point 84-88? Alfa-Aesar
Melting_Point 84-88° Alfa-Aesar
Purity 95% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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