UCSF

ZINC04501386

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 5th, 2005 11 No

Popular Name: Alpha-methylcinnamaldehyde Alpha-methylcinnamaldehyde

Find On: PubMed — Wikipedia — Google

CAS Numbers: 101-39-3 , 4549-82-0 , [101-39-3]

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) 3.03 5.97 -6.81 0 1 0 17 146.189 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 132 / 16 TCI
Boiling_Point 138-140?/14mm Alfa-Aesar
Boiling_Point 138-140°/14mm Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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