UCSF

ZINC00136173

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: [1,1'-biphenyl]-2,2'-dicarbonitrile [1,1'-biphenyl]-2,2'-dicarbonitrile

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CAS Numbers: 4341-02-0 , [4341-02-0]

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) 3.15 4.11 -11.4 0 2 0 47 204.232 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0176956A2; EP0176956B1 IBM Patent Data

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