UCSF

ZINC19735913

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 11 Yes

Popular Name: 2-Amino-3-(trifluoromethyl)pyridine 2-Amino-3-(trifluoromethyl)pyridine

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CAS Numbers: 1228879-38-6 , 183610-70-0 , [1228879-38-6] , [183610-70-0]

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) 1.37 2.58 -4.61 2 2 0 39 162.114 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 66-71° Oakwood Chemical
Melting_Point 70-72? Alfa-Aesar
MP 70-72° Matrix Scientific
Purity 98% Matrix Scientific
Warnings IRRITANT, TOXIC Matrix Scientific
Warnings Toxic/Irritant Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.