AC1O2JOC structure

AC1O2JOC

methyl (4Z)-2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrrole-3-carboxylate

Also Known As: SR-01000482728-1|methyl (4Z)-2-methyl-1-(4-methylbenzyl)-5-oxo-4-(3,4,5-trimethoxybenzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate|METHYL (4Z)-2-METHYL-1-[(4-METHYLPHENYL)METHYL]-5-OXO-4-[(3,4,5-TRIMETHOXYPHENYL)METHYLIDENE]-4,5-DIHYDRO-1H-PYRROLE-3-CARBOXYLATE|methyl (4Z)-2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrrole-3-carboxylate|Methyl (4Z)-4,5-dihydro-2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-4-[(3,4,5-trimethoxyphenyl)methylene]-1H-pyrrole-3-carboxylate

CAS: 1164555-68-3
Molecular Formula C25H27NO6
Molecular Weight 437.18384 g/mol
LogP 3.89362
Topological Polar Surface Area 74.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 437.18384
Monoisotopic Mass 437.18384
Heavy Atoms 32
Complexity 1072.9104

Chemical Identifiers

CAS Number 1164555-68-3
SMILES CC1=CC=C(C=C1)CN2C(=C(/C(=C/C3=CC(=C(C(=C3)OC)OC)OC)/C2=O)C(=O)OC)C

Product Overview

AC1O2JOC (CAS 1164555-68-3), with molecular formula C25H27NO6 and molecular weight 437.18384 g/mol. IUPAC: methyl (4Z)-2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrrole-3-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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