UCSF

ZINC16124860

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 22nd, 2008 13 Yes

Popular Name: 2,4-Dichlorobenzoylacetonitrile 2,4-Dichlorobenzoylacetonitrile

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CAS Numbers: 39528-61-5 , [39528-61-5]

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) 2.20 6.46 -16.56 0 2 0 41 214.051 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 62 - 64 Enamine Building Blocks
MP 62...64 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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