UCSF

ZINC00167141

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 No

Popular Name: 4-(Trifluoromethoxy)benzyl mercaptan 4-(Trifluoromethoxy)benzyl merca…

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CAS Numbers: 175278-03-2 , [175278-03-2]

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) 3.20 2.04 -3.07 0 1 0 9 208.204 3 ↓
Hi High (pH 8-9.5) 3.20 1.08 -39.5 0 1 -1 9 207.196 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 93-95°/15mm Fluorochem
Purity 97% Fluorochem

Activity (Go SEA)

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