UCSF

ZINC17061534

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2008 13 No

Popular Name: benzeneazomalononitrile benzeneazomalononitrile

Find On: PubMed — Wikipedia — Google

CAS Numbers: 306-18-3 , 6017-21-6 , [6017-21-6]

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) 1.71 3.58 -8.5 0 4 0 72 170.175 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0383449B1 IBM Patent Data

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