UCSF

ZINC01586425

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 11 Yes

Popular Name: 2-(4-Chlorophenoxy)ethanol 2-(4-Chlorophenoxy)ethanol

Find On: PubMed — Wikipedia — Google

CAS Number: 1892-43-9

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) 2.04 -1.72 -5.57 1 2 0 29 172.611 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 135-136?/6mm Alfa-Aesar
Boiling_Point 135-136°/6mm Alfa-Aesar
BP 187 / 53 TCI
Melting_Point 30? Alfa-Aesar
Melting_Point 30° Alfa-Aesar

Activity (Go SEA)

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