1192-58-1 | 1-Methyl-1H-pyrrole-2-carbaldehyde

Packsize	Purity	Availability	Price	Discounted Price
5g	97%	in stock	$16.00	$11.00
10g	97%	in stock	$24.00	$17.00
25g	97%	in stock	$43.00	$30.00
50g	97%	in stock	$74.00	$52.00
100g	97%	in stock	$130.00	$91.00

Description

• Catalog Number: AA23576
• Chemical Name: 1-Methyl-1H-pyrrole-2-carbaldehyde
• CAS Number: 1192-58-1
• Molecular Formula: C6H7NO
• Molecular Weight: 109.12588000000002
• MDL Number: MFCD00003087
• SMILES: O=Cc1cccn1C
• NSC Number: 72386

Computed Properties

• Complexity: 92.5
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 0.5

Upstream Synthesis Route

1H-Pyrrole-2-carboxaldehyde, 1-methyl- is a versatile compound widely utilized in chemical synthesis processes. This specific derivative of pyrrole plays a crucial role in the construction of various complex molecules due to its unique reactivity and structural properties. With its carbon-carbon double bond and nitrogen-containing heterocyclic ring, this compound serves as a valuable building block in the creation of pharmaceuticals, agrochemicals, and functional materials in the field of organic chemistry. Its ability to participate in diverse organic reactions, such as condensations, cyclizations, and cross-coupling reactions, makes it a valuable tool for synthetic chemists aiming to design and produce novel molecular structures with potential applications in various industries.

Literature

• 2-[(1-Methyl-1H-pyrrol-2-yl)methyl-idene]propane-dinitrile.

  Acta crystallographica. Section E, Structure reports online 20120401

• A combined experimental and computational thermodynamic study of the isomers of pyrrolecarboxaldehyde and 1-methyl- pyrrolecarboxaldehyde.

  The journal of physical chemistry. B 20111103

• (E)-3-(1-Methyl-1H-pyrrol-2-yl)-1-phenyl-prop-2-en-1-one.

  Acta crystallographica. Section E, Structure reports online 20110401

• N-[(Z)-(1-Methyl-1H-pyrrol-2-yl)methyl-idene]-1H-1,2,4-triazol-5-amine.

  Acta crystallographica. Section E, Structure reports online 20090101

• Diethyl 2-[(1-methyl-1H-pyrrol-2-yl)methyl-ene-amino]-5-(2-thienylmethyl-ene-amino)thio-phene-3,4-dicarboxyl-ate.

  Acta crystallographica. Section E, Structure reports online 20080501

• 11-Methyl-2,3-benzodipyrrin-1-one.

  Acta crystallographica. Section C, Crystal structure communications 20041201

• Effect of the pyrrole polymerization mechanism on the antioxidative activity of nonenzymatic browning reactions.

  Journal of agricultural and food chemistry 20030910

• Antioxidative activity of heterocyclic compounds found in coffee volatiles produced by Maillard reaction.

  Journal of agricultural and food chemistry 20020911