UCSF

ZINC00162618

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 No

Popular Name: 1-(4-Methoxy-3-nitrophenyl)ethanone 1-(4-Methoxy-3-nitrophenyl)ethanone

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CAS Number: 6277-38-9

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) 1.78 5.73 -17.51 0 5 0 72 195.174 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Melting_Point 97-99? Alfa-Aesar
Melting_Point 97-99° Alfa-Aesar
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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