UCSF

ZINC02031351

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 12 Yes

Popular Name: delta-Decalactone delta-Decalactone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 27593-23-3 , 705-86-2 , [705-86-2]

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) 3.21 1.98 -7.27 0 2 0 26 170.252 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 25? Alfa-Aesar
Melting_Point 25° Alfa-Aesar
Boiling_Point 117-120?/0.02m Alfa-Aesar
Boiling_Point 117-120°/0.02m Alfa-Aesar
BP 123 / 3 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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