6960-42-5 | 7-Nitroindole

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$6.00	$4.00
5g	98%	in stock	$15.00	$11.00
10g	98%	in stock	$27.00	$19.00
25g	98%	in stock	$65.00	$46.00
100g	98%	in stock	$237.00	$166.00
500g	98%	in stock	$1,113.00	$779.00

Description

• Catalog Number: AB70179
• Chemical Name: 7-Nitroindole
• CAS Number: 6960-42-5
• Molecular Formula: C8H6N2O2
• Molecular Weight: 162.1454
• MDL Number: MFCD00005683
• SMILES: [O-][N+](=O)c1cccc2c1[nH]cc2
• NSC Number: 69874

Computed Properties

• Complexity: 190
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• XLogP3: 2.6

Upstream Synthesis Route

7-Nitro-1H-indole is a versatile compound that finds wide application in chemical synthesis, specifically in the pharmaceutical and agrochemical industries. This compound serves as a key building block for the synthesis of various biologically active molecules due to its unique structure and reactivity. In chemical synthesis, 7-Nitro-1H-indole can be utilized as a precursor for the preparation of indole derivatives, which are important structural motifs found in many natural products and pharmaceutical compounds. Its nitro group can be selectively modified to introduce different functional groups, allowing for the generation of diverse chemical libraries for drug discovery purposes. Furthermore, 7-Nitro-1H-indole can participate in a variety of reactions such as nucleophilic substitution, reduction, and condensation reactions, enabling the creation of complex molecular frameworks with high efficacy and selectivity. Its presence in the synthesis of heterocyclic compounds contributes significantly to the development of new drugs, pesticides, and other bioactive molecules with potential applications in the fields of medicine and agriculture.

Literature

• Direct functionalization of (un)protected tetrahydroisoquinoline and isochroman under iron and copper catalysis: two metals, two mechanisms.

  The Journal of organic chemistry 20111104

• A novel role of prostaglandin E2 in neuropathic pain: blockade of microglial migration in the spinal cord.

  Glia 20110201

• Rapid S-nitrosylation of actin by NO-generating donors and in inflammatory pain model mice.

  Molecular pain 20110101