UCSF

ZINC44199761

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 12 Yes

Popular Name: Methyl 2-fluoro-5-methylbenzoate Methyl 2-fluoro-5-methylbenzoate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2967-93-3 , [2967-93-3]

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) 2.31 5.83 -8.52 0 2 0 26 168.167 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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