UCSF

ZINC02036793

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 14 No

Popular Name: Isopropyl cinnamate Isopropyl cinnamate

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CAS Numbers: 50-68-0 , 6/5/7780 12:00:00 AM , 7780-06-5 , 7780/6/5

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) 3.27 2.9 -5.55 0 2 0 26 190.242 4 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 268 - 270 Acros Organics
Boiling_Point 268-270? Alfa-Aesar
Boiling_Point 268-270° Alfa-Aesar
BP 270 TCI
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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