UCSF

ZINC00128879

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: 4'-(Trifluoromethoxy)acetanilide 4'-(Trifluoromethoxy)acetanilide

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CAS Numbers: 1737-06-0 , [1737-06-0]

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) 2.13 1.62 -7.94 1 3 0 38 219.162 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 114-117? Alfa-Aesar
Melting_Point 114-117° Alfa-Aesar
MP 115-117° Matrix Scientific
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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