UCSF

ZINC02534747

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 3-Methoxyphenylacetone 3-Methoxyphenylacetone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3027-13-2 , [3027-13-2]

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) 1.70 5.07 -9.29 0 2 0 26 164.204 3 ↓

Vendor Notes

Note Type Comments Provided By
M.P 258 °C Indofine
Boiling_Point 258-260? Alfa-Aesar
Boiling_Point 258-260° Alfa-Aesar
Purity 99% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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