UCSF

ZINC00083383

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 No

Popular Name: 5-Benzyloxy-2-nitrotoluene 5-Benzyloxy-2-nitrotoluene

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CAS Numbers: 22424-58-4 , [22424-58-4]

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) 3.92 2.13 -7.1 0 4 0 55 243.262 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 69-70? Alfa-Aesar
Melting_Point 69-70° Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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