UCSF

ZINC02572852

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 15 No

Popular Name: 3-(4-Methoxyphenyl)-3-oxo-propionic acid methylester 3-(4-Methoxyphenyl)-3-oxo-propio…

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CAS Number: 22027-50-5

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) 1.34 6.04 -14.62 0 4 0 53 208.213 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 135°/0.27mm Oakwood Chemical
MP 40-42° Oakwood Chemical
Purity 95% Fluorochem
Purity 97% Fluorochem
Purity 98% APIChem

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