UCSF

ZINC12370408

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 15 Yes

Popular Name: 2-Phenoxybenzonitrile 2-Phenoxybenzonitrile

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CAS Number: 6476-32-0

Other Names:

MFCD08271960

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) 3.40 3.24 -9.19 0 2 0 33 195.221 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0662477A1; US4413003; US4414210; US5716974 IBM Patent Data
PUBCHEM_PATENT_ID US4297370; WO1993000809A1 IBM Patent Data

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