UCSF

ZINC04942727

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2006 17 No

Popular Name: 3-allyl-4-isopropoxy-5-methoxybenzaldehyde 3-allyl-4-isopropoxy-5-methoxybe…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 883543-95-1 , [883543-95-1]

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) 3.06 3.47 -7.98 0 3 0 35 234.295 6 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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