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Structure

6-Bromo-1,2-benzisoxazole-3-carboxylic acid ethyl ester

CAS
651780-27-7
Catalog Number
ACM651780277
Category
Other Products
Molecular Weight
270.08
Molecular Formula
C10H8BrNO3

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Specification

Synonyms
6-Bromo-1,2-benzisoxazole-3-carboxylic acid ethyl ester;Ethyl 6-bromobenzo[d]isoxazole-3-carboxylate
IUPAC Name
ethyl 6-bromo-1,2-benzoxazole-3-carboxylate
Canonical SMILES
CCOC(=O)C1=NOC2=C1C=CC(=C2)Br
InChI Key
ADEQGMXEHRCMKL-UHFFFAOYSA-N
Density
1.587
H-Bond Acceptor
4
H-Bond Donor
0

Upstream Synthesis Route 1

  • 199328-35-3
  • 651780-27-7

Reference: [1] Patent: WO2005/63767, 2005, A2, . Location in patent: Page/Page column 44

Upstream Synthesis Route 2

  • 141-52-6
  • 100487-82-9
  • 651780-27-7

Reference: [1] Patent: WO2016/115282, 2016, A1, . Location in patent: Page/Page column 80

Downstream Synthesis Route 1

  • 651780-27-7
  • 57764-49-5

Reference: [1] Patent: WO2005/63767, 2005, A2, . Location in patent: Page/Page column 44-45

Downstream Synthesis Route 2

  • 651780-27-7
  • 1423-27-4
  • 668970-58-9

Reference: [1]Patent: WO2004/18428,2004,A1 .Location in patent: Page 153-154

Downstream Synthesis Route 3

  • 651780-27-7
  • 16419-60-6
  • 668970-09-0

Reference: [1]Patent: WO2004/18428,2004,A1 .Location in patent: Page 130

Downstream Synthesis Route 4

  • 668261-28-7
  • 651780-27-7
  • 668970-13-6

Reference: [1]Patent: WO2004/18428,2004,A1 .Location in patent: Page 131-132

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

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