UCSF

ZINC02584856

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 18 No

Popular Name: 2-tert-butyl 4-methyl 5-amino-3-methylthiophene-2,4-dicarboxylate 2-tert-butyl 4-methyl 5-amino-3-…

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CAS Numbers: , 827614-43-7

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) 2.60 0.86 -9.52 2 5 0 78 271.338 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 124-127° Oakwood Chemical
MP 124-127°C Fluorochem
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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