UCSF

ZINC00163954

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 10 Yes

Popular Name: 5-Methylbenzoxazole 5-Methylbenzoxazole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 10531-78-9 , [10531-78-9]

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) 2.15 -0.33 -7.78 0 2 0 26 133.15 0 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 41-44? Alfa-Aesar
Melting_Point 41-44° Alfa-Aesar
MP 45 TCI
melting_point 45 - 47 KeyOrganics
BP 96 / 15 TCI
Purity 97% Fluorochem

Activity (Go SEA)

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