7-Nitro-3,4-dihydro-2H-1,4-benzoxazine

• CAS: 120711-81-1
• Catalog Number: ACM120711811
• Category: Other Products
• Molecular Weight: 180.16
• Molecular Formula: C8H8N2O3
• Synonyms: 120711-81-1, 7-Nitro-3,4-dihydro-2H-1,4-benzoxazine, 7-Nitro-3,4-dihydro-2H-1,4-benzooxazine, 7-NITRO-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE, SureCN303351, AGN-PC-01VQ9G, CTK4B1995, MolPort-008-502-688, ANW-49876, SBB089639, ZINC19769972, AKOS005072293, AB64327, AG-D-45188, CD-0744, MCULE-3126906357, RP10868, AK-49011, BR-49011, KB-250117
• IUPAC Name: 7-nitro-3,4-dihydro-2H-1,4-benzoxazine
• Canonical SMILES: C1COC2=C(N1)C=CC(=C2)[N+](=O)[O-]
• InChI Key: YKCFDUNYLMTXFC-UHFFFAOYSA-N
• Exact Mass: 180.05300
• H-Bond Acceptor: 4
• H-Bond Donor: 1

Synthetic Use

Upstream Synthesis Route 1

• 81721-86-0

• 120711-81-1

Reference: [1] Journal of Medicinal Chemistry, 2007, vol. 50, # 10, p. 2486 - 2496
[2] Patent: WO2006/66174, 2006, A1, . Location in patent: Page/Page column 52-53
[3] Patent: US2010/9975, 2010, A1, . Location in patent: Page/Page column 35
[4] Journal of the American Chemical Society, 2014, vol. 136, # 38, p. 13277 - 13282
[5] Bioorganic and Medicinal Chemistry, 2013, vol. 21, # 13, p. 3821 - 3830

Upstream Synthesis Route 2

• 106-93-4
• 121-88-0

• 120711-81-1

Reference: [1] Patent: CN103382206, 2016, B, . Location in patent: Paragraph 0428-0433

Upstream Synthesis Route 3

• 120711-94-6

• 120711-81-1

Reference: [1] Patent: CN104693216, 2017, B, . Location in patent: Paragraph 0057-0061

Downstream Synthesis Route 1

• 108-24-7
• 120711-81-1

• 120711-94-6

Reference: [1]Journal of Medicinal Chemistry,1989,vol. 32,p. 1627 - 1630

Downstream Synthesis Route 2

• 98-88-4
• 120711-81-1

• 120711-98-0

Reference: [1]Journal of Medicinal Chemistry,1989,vol. 32,p. 1627 - 1630

* For details of the synthesis route, please refer to the original source to ensure accuracy.