2H-1,4-Benzoxazin-3(4H)-one,6-chloro-

• CAS: 7652-29-1
• Catalog Number: ACM7652291
• Category: Other Products
• Molecular Weight: 183.59
• Molecular Formula: C8H6 Cl N O2
• Synonyms: 658278_ALDRICH, NSC211462, SBB003725, ZINC03764782, 6-Chloro-2H-1,4-benzoxazin-3(4H)-one, 6-Chloro-4H-benzo[1,4]oxazin-3-one, BAS 09179234, EU-0030123, AE-641/01183042, 7652-29-1
• IUPAC Name: 6-chloro-4H-1,4-benzoxazin-3-one
• Canonical SMILES: C1C(=O)NC2=C(O1)C=CC(=C2)Cl
• InChI Key: OBPIPKQQNRACHV-UHFFFAOYSA-N
• Boiling Point: 363ºC at 760 mmHg
• Melting Point: 215-219ºC
• Flash Point: 173.3ºC
• Density: 1.393g/cm³
• Exact Mass: 183.00900
• Hazard Statements: Xn,Xi
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Safety Description: 26

Synthetic Use

Upstream Synthesis Route 1

• 35588-38-6

• 7652-29-1

Reference: [1]Turk; Krapcho; Michel; Weinryb
[Journal of Medicinal Chemistry, 1977, vol. 20, # 5, p. 729 - 732]

Downstream Synthesis Route 1

• 7652-29-1

• 70558-11-1

Reference: [1] Patent: US2008/305169, 2008, A1,

Downstream Synthesis Route 2

• 7652-29-1
• 544-92-3

• 134997-74-3

Reference: [1] Patent: US2006/173183, 2006, A1, . Location in patent: Page/Page column 104

Downstream Synthesis Route 3

• 7652-29-1

• 134997-74-3

Reference: [1] Journal of Medicinal Chemistry, 2012, vol. 55, # 2, p. 709 - 716

Downstream Synthesis Route 4

• 7652-29-1
• 541-41-3

• 104829-92-7

Reference: [1]Zuo, Hua; Meng, Lijuan; Ghate, Manjunath; Hwang, Kyu-Hyeon; Kweon Cho, Yong; Chandrasekhar; Raji Reddy; Shin, Dong-Soo
[Tetrahedron Letters, 2008, vol. 49, # 23, p. 3827 - 3830]

Downstream Synthesis Route 5

• 7652-29-1
• 105-36-2

• 26494-57-5

Reference: [1]Hashimoto; Ishizaki; Shudo; Okamoto
[Chemical and Pharmaceutical Bulletin, 1983, vol. 31, # 11, p. 3891 - 3896]

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