UCSF

ZINC01579097

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 13 No

Popular Name: 4-Nitrophenylglyoxal hydrate 4-Nitrophenylglyoxal hydrate

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CAS Numbers: 4974-57-6 , 4996-22-9 , 92304-49-9 , [4996-22-9]

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) 1.24 5.81 -15.21 0 5 0 80 179.131 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Melting_Point 96-98? Alfa-Aesar
Melting_Point 96-98° Alfa-Aesar
Warnings IRRITANT Matrix Scientific

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