UCSF

ZINC00056785

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 No

Popular Name: 1-(4-nitrophenyl)propane-1,2,3-triol 1-(4-nitrophenyl)propane-1,2,3-t…

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CAS Numbers: 2207-68-3 , [2207-68-3]

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) -0.19 -1.34 -12.25 3 6 0 107 213.189 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Melting_Point 95-97? Alfa-Aesar
Melting_Point 95-97° Alfa-Aesar

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