4-Acetamidophenyl [1-Methyl-5-(4-Methylbenzoyl)-1H-Pyrrol-2-Yl]Acetate

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Properties Simple | Detailed

Formula C23H22N2O4
IUPAC Name (4-acetamidophenyl) 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate
Molecular Mass 390.432 g·mol−1
Heat of Formation -425.6 ± 16.7 kJ·mol−1
Dipole Moment 4.76 ± 1.08 D
Volume 464.3 Å 3
Surface Area 420.33 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • (4-acetamidophenyl) 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate
  • (4-acetamidophenyl) 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoate
  • 1h-pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-, 4-(acetylamino)phenyl ester
  • 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetic acid (4-acetamidophenyl) ester
  • 2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]acetic acid (4-acetamidophenyl) ester
  • 4-(acetylamino)phenyl 1-methyl-5-(4-methylbenzoyl)-1h-pyrrole-2-acetate
  • au 8001
CAS Number(s)
  • 82239-77-8
InChIKey FILYHFFLMZBUSY-UHFFFAOYSA-N
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