UCSF

ZINC02146992

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 12 Yes

Popular Name: 2-(4-Methoxyphenoxy)acetonitrile 2-(4-Methoxyphenoxy)acetonitrile

Find On: PubMed — Wikipedia — Google

CAS Numbers: 22446-12-4 , [22446-12-4]

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) 1.84 3.78 -9.43 0 3 0 42 163.176 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 106-110?/0.1mm Alfa-Aesar
Boiling_Point 106-110°/0.1mm Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem

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