UCSF

ZINC00355209

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: 1-(4-Isobutoxyphenyl)propan-1-one 1-(4-Isobutoxyphenyl)propan-1-one

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CAS Numbers: 354539-62-1 , N/A , [354539-62-1]

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) 3.52 2.17 -6.97 0 2 0 26 206.285 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity 90% Fluorochem
Warnings IRRITANT Matrix Scientific

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