UCSF

ZINC03130524

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 11 Yes

Popular Name: 2-(benzyloxy)acetonitrile 2-(benzyloxy)acetonitrile

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CAS Numbers: 13620-31-0 , 92552-22-2

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) 1.68 1.93 -9.13 0 2 0 33 147.177 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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