UCSF

ZINC39370473

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2010 18 No

Popular Name: benzyl 1-oxa-6-azaspiro[2.5]octane-6-carboxylate benzyl 1-oxa-6-azaspiro[2.5]octa…

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CAS Numbers: 77211-75-7 , [77211-75-7]

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) 2.09 5.83 -7.69 0 4 0 42 247.294 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific
melting_point Oil KeyOrganics

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