UCSF

ZINC01587818

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 13 Yes

Popular Name: 3-((2-Ethylhexyl)oxy)propan-1-amine 3-((2-Ethylhexyl)oxy)propan-1-amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 5397-31-9 , [5397-31-9]

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) 2.56 5.05 -41.2 3 2 1 37 188.335 9 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 70? Alfa-Aesar
Melting_Point 70° Alfa-Aesar
Boiling_Point 152?/13mm Alfa-Aesar
Boiling_Point 152°/13mm Alfa-Aesar
BP 78 / 1 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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