UCSF

ZINC02534746

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 12 No

Popular Name: 2-Methoxyphenylacetone 2-Methoxyphenylacetone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 5211-62-1 , [5211-62-1]

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) 1.67 5.12 -8.56 0 2 0 26 164.204 3 ↓

Vendor Notes

Note Type Comments Provided By
M.P 127-130°C Indofine
Boiling_Point 128-131?/11mm Alfa-Aesar
Boiling_Point 128-131°/11mm Alfa-Aesar
MP 136 - 138 Enamine Building Blocks
MP 136...138 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity ¡Ý99% APIChem

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