UCSF

ZINC39278973

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 12 No

Popular Name: Methyl 6-(bromomethyl)nicotinate Methyl 6-(bromomethyl)nicotinate

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CAS Numbers: , 131803-48-0 , 283173-39-7

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) 1.31 4.68 -6.44 0 3 0 39 230.061 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 72-76° Oakwood Chemical
Purity 90+% Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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