UCSF

ZINC02527751

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 12 No

Popular Name: 2-Chloro-2',5'-difluoroacetophenone 2-Chloro-2',5'-difluoroacetophenone

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CAS Numbers: 60468-36-2 , [60468-36-2]

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) 2.32 2.71 -9.03 0 1 0 17 190.576 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 116 - 119 Enamine Building Blocks
MP 116...119 Enamine Building Blocks
MP 49-50° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 96% Matrix Scientific
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Lachrymator Matrix Scientific

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )