UCSF

ZINC33505642

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2009 13 Yes

Popular Name: ethyl 2-(4-fluorophenyl)acetate ethyl 2-(4-fluorophenyl)acetate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 587-88-2 , [587-88-2]

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) 2.52 6.9 -7.18 0 2 0 26 182.194 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 29 - 31 Enamine Building Blocks
MP 29...31 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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