UCSF

ZINC00084547

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2005 17 Yes

Popular Name: 8-ethoxy-2-oxo-2H-chromene-3-carboxylic acid 8-ethoxy-2-oxo-2H-chromene-3-car…

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CAS Numbers: 81017-24-5 , [81017-24-5]

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) 1.90 6.65 -63.44 0 5 -1 80 233.199 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 185 - 188 KeyOrganics
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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