UCSF

ZINC38293318

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 14th, 2010 15 Yes

Popular Name: Methyl 4-fluoro-3-prop-2-ynyloxy-benzoate Methyl 4-fluoro-3-prop-2-ynyloxy…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 214822-98-7 , [214822-98-7]

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) 2.42 5.97 -8.14 0 3 0 36 208.188 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95%+ Matrix Scientific
Warnings IRRITANT Matrix Scientific

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