AC1MOFC8 structure

AC1MOFC8

methyl 4-[[2-(2,5-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Also Known As: methyl 4-[[2-(2,5-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate|methyl 4-[2-(2,5-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

CAS: 858751-16-3
Molecular Formula C26H33N3O7
Molecular Weight 499.23184 g/mol
LogP 2.80874
Topological Polar Surface Area 121.4 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 9
Exact Mass 499.23184
Monoisotopic Mass 499.23184
Heavy Atoms 36
Complexity 1212.3604

Chemical Identifiers

CAS Number 858751-16-3
SMILES CC1=C(NC(=C1C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=C(C=CC(=C3)OC)OC)O)C)C(=O)OC

Product Overview

AC1MOFC8 (CAS 858751-16-3), with molecular formula C26H33N3O7 and molecular weight 499.23184 g/mol. IUPAC: methyl 4-[[2-(2,5-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate.

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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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