UCSF

ZINC00150342

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: 6-Fluoro-2-methylquinoline 6-Fluoro-2-methylquinoline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1128-61-6 , [1128-61-6]

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) 1.16 5.56 -5.6 0 1 0 13 161.179 0 ↓
Lo Low (pH 4.5-6) 1.16 5.82 -29.89 1 1 1 14 162.187 0 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 52-56? Alfa-Aesar
Melting_Point 52-56° Alfa-Aesar
MP 53 TCI
MP 54-56° Fluorochem
BP 80°/1mm Oakwood Chemical
Purity 97% Fluorochem
BP 99 / 3 TCI
SOLUBILITY Soluble in Chloroform Indofine

Activity (Go SEA)

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