UCSF

ZINC01690127

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 Yes

Popular Name: 4-butoxyphenol 4-butoxyphenol

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CAS Numbers: 122-94-1 , [122-94-1]

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) 2.95 -0.56 -4.17 1 2 0 29 166.22 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 165 / 2 TCI
Melting_Point 63-66? Alfa-Aesar
Melting_Point 63-66° Alfa-Aesar
MP 66 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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