UCSF

ZINC00166616

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 No

Popular Name: ethyl 3-(2-furyl)-3-oxopropanoate ethyl 3-(2-furyl)-3-oxopropanoate

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CAS Numbers: 615-09-8 , 887411-85-0 , 9/8/615 , [615-09-8]

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) 0.92 5.82 -11.75 0 4 0 57 182.175 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 114°/2mm Matrix Scientific
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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