UCSF

ZINC00107256

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 13 Yes

Popular Name: 3-(4-Fluorophenoxy)propionic acid 3-(4-Fluorophenoxy)propionic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1579-78-8 , 2967-70-6 , [1579-78-8]

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) 1.67 4.62 -41.96 0 3 -1 49 183.158 4 ↓
Mid Mid (pH 6-8) 1.64 6.84 -19.08 2 8 0 91 422.485 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 84 - 86 Enamine Building Blocks
MP 84-86° Matrix Scientific
MP 84...86 Enamine Building Blocks
MP 85 - 86 Enamine Building Blocks
MP 86 - 86 Enamine Building Blocks
MP 86 - 88 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Purity 97+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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