UCSF

ZINC12419677

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2008 15 No

Popular Name: 8-Methoxy-3,4-dihydro-2H-benzo[b][1,4]dioxepine-7-carbaldehyde 8-Methoxy-3,4-dihydro-2H-benzo[b…

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CAS Numbers: 919016-99-2 , [919016-99-2]

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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) 1.49 4.77 -10.29 0 4 0 45 208.213 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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