UCSF

ZINC21992393

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 13 No

Popular Name: 1-(4-Chloro-2-nitrophenyl)ethanone 1-(4-Chloro-2-nitrophenyl)ethanone

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CAS Numbers: 23082-51-1 , 5465-65-6 , [23082-51-1]

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) 2.40 6.03 -8.34 0 4 0 63 199.593 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 98.5% min APIChem

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