3,4-Diisovaleryl adrenalone structure

3,4-Diisovaleryl adrenalone

[4-[2-(methylamino)acetyl]-2-(2-methylbutanoyloxy)phenyl] 2-methylbutanoate

Also Known As: Agp-dermorphin|3,4-Diisovaleryl adrenalone|2-Arg-3-gly-4-phe-dermorphin|Dermorphin, arg(2)-gly(3)-phe(4)-|Butanoic acid, 3-methyl-, (11beta,16alpha)-|4-(n-methylglycyl)benzene-1,2-diyl bis(2-methylbutanoate)|4-(N-Methylglycyl)-1,2-phenylene bis(2-methylbutanoate)|Dermorphin, arginyl(2)-glycyl(3)-phenylalanine(4)-|[4-[2-(methylamino)acetyl]-2-(2-methylbutanoyloxy)phenyl] 2-methylbutanoate

CAS: 98495-22-8
Molecular Formula C19H27NO5
Molecular Weight 349.18893 g/mol
LogP 3.5
Topological Polar Surface Area 81.7 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 11
Exact Mass 349.18893
Monoisotopic Mass 349.18893
Heavy Atoms 25
Complexity 465.0

Chemical Identifiers

CAS Number 98495-22-8
SMILES CCC(C)C(=O)OC1=C(C=C(C=C1)C(=O)CNC)OC(=O)C(C)CC
InChIKey MUULHPNPXBMEQL-UHFFFAOYSA-N

Product Overview

3,4-Diisovaleryl adrenalone (CAS 98495-22-8), with molecular formula C19H27NO5 and molecular weight 349.18893 g/mol. IUPAC: [4-[2-(methylamino)acetyl]-2-(2-methylbutanoyloxy)phenyl] 2-methylbutanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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