UCSF

ZINC19928448

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 18 Yes

Popular Name: 5-(Benzyloxy)-4-oxo-4H-pyran-2-carboxylic acid 5-(Benzyloxy)-4-oxo-4H-pyran-2-c…

Find On: PubMed — Wikipedia — Google

CAS Number: 1219-33-6

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) 1.22 6.48 -45.33 0 5 -1 80 245.21 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 179 - 181 Enamine Building Blocks
MP 179...181 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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