UCSF

ZINC05733571

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2006 13 No

Popular Name: 2-Methoxy-5-nitrobenzonitrile 2-Methoxy-5-nitrobenzonitrile

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 10496-75-0 , [10496-75-0]

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) 1.64 4.88 -10.05 0 5 0 79 178.147 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 69 - 71 Enamine Building Blocks
MP 69...71 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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