UCSF

ZINC03882888

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 14 No

Popular Name: 8-methoxy-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde 8-methoxy-2,3-dihydro-1,4-benzod…

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CAS Numbers: 75889-54-2 , [75889-54-2]

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 3.26 -11.68 0 4 0 45 194.186 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 81 - 83 Enamine Building Blocks
MP 81...83 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Fluorochem
Warnings IRRITANT Matrix Scientific

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