UCSF

ZINC00338008

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 9 Yes

Popular Name: 4-Methyl-2-(methylthio)pyrimidine 4-Methyl-2-(methylthio)pyrimidine

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CAS Numbers: 113676-50-9 , 14001-63-9 , [14001-63-9]

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) 1.71 3.67 -6.84 0 2 0 26 140.211 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 78-80°/1mm Matrix Scientific
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific
melting_point Oil KeyOrganics

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