UCSF

ZINC01235041

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 10 No

Popular Name: 1-ethyl-3-methylpiperidin-4-one 1-ethyl-3-methylpiperidin-4-one

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3612-16-6 , [3612-16-6]

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) 0.77 5.1 -40.14 1 2 1 22 142.222 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 72?/7.6mm Alfa-Aesar
Boiling_Point 72°/7.6mm Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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