2H-3,1-Benzoxazine-2,4(1H)-dione,5-bromo-

CAS

77603-45-3

Catalog Number

ACM77603453

Category

Other Products

Molecular Weight

284.88

Molecular Formula

C₈H₄BrNO₃

MSDS COA Spec Sheet

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Specification

Synonyms

6-BROMOISATIN;

IUPAC Name

5-bromo-1H-3,1-benzoxazine-2,4-dione

Canonical SMILES

C1=CC2=C(C(=C1)Br)C(=O)OC(=O)N2

InChI Key

YELXVMUMHRDCKE-UHFFFAOYSA-N

Melting Point

99-103ºC

Density

1.826 g/cm³

Exact Mass

224.94300

Hazard Statements

Safety Description

S26

Upstream Synthesis Route 1

65971-74-6

76561-16-5
77603-45-3

Reference: [1] Australian Journal of Chemistry, 1999, vol. 52, # 11, p. 1061 - 1069

Upstream Synthesis Route 2

75-44-5
20776-48-1

77603-45-3

Reference: [1] Australian Journal of Chemistry, 1999, vol. 52, # 11, p. 1061 - 1069
[2] Journal of Labelled Compounds and Radiopharmaceuticals, 1996, vol. 38, # 9, p. 835 - 845

Upstream Synthesis Route 3

20780-72-7

77603-45-3

Reference: [1] Catalysis Science and Technology, 2015, vol. 5, # 10, p. 4830 - 4838
[2] Patent: US5599814, 1997, A,

Upstream Synthesis Route 4

75-44-5
20776-48-1

77603-45-3

Reference: [1]Australian Journal of Chemistry,1999,vol. 52,p. 1061 - 1069
[2]Journal of labelled compounds and radiopharmaceuticals,1996,vol. 38,p. 835 - 845