Structure

5-Bromo-1-isoindolinone,96%

CAS
552330-86-6
Catalog Number
ACM552330866
Category
Other Products
Molecular Weight
212.04
Molecular Formula
C8H6BrNO

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Specification

Synonyms
5-bromoisoindolin-1-one, 5-Bromo-2,3-dihydroisoindol-1-one, 552330-86-6, 5-bromo-2,3-dihydro-1H-isoindol-1-one, ACMC-1AW2C, SureCN275805, 5-BROMO-1-ISOINDOLINONE, CTK5A3253, MolPort-009-197-648, ANW-49882, ZINC40448503, AKOS015835991, ACN-000022, AG-I-03238, PB29649, QC-2497, RP26650, AK-29385, BR-29385, KB-41938
IUPAC Name
5-bromo-2,3-dihydroisoindol-1-one
SMILES
C1C2=C(C=CC(=C2)Br)C(=O)N1
InChI Key
WJNKJYJCWXMBNV-UHFFFAOYSA-N
Boiling Point
448.367ºC at 760 mmHg
Flash Point
224.965ºC
Density
1.666g/cm³
Exact Mass
210.96300
H-Bond Acceptor
1
H-Bond Donor
1

Upstream Synthesis Route 1

  • 78471-43-9
  • 552330-86-6

Reference: [1] Patent: WO2006/20879, 2006, A1, . Location in patent: Page/Page column 66-67

Upstream Synthesis Route 2

  • 68837-59-2
  • 552330-86-6

Reference: [1] Patent: WO2007/131991, 2007, A1, . Location in patent: Page/Page column 91

Downstream Synthesis Route 1

  • 552330-86-6
  • 74-88-4
  • 868066-91-5

Reference: [1] Patent: WO2014/28968, 2014, A1, . Location in patent: Page/Page column 64

Downstream Synthesis Route 2

  • 552330-86-6
  • 73183-34-3
  • 376584-62-2

Reference: [1]Patent: WO2008/23161,2008,A1 .Location in patent: Page/Page column 121-122

Downstream Synthesis Route 3

  • 552330-86-6
  • 131184-73-1
  • 1194551-69-3

Reference: [1]Organic Letters,2009,vol. 11,p. 5154 - 5157

Downstream Synthesis Route 4

  • 552330-86-6
  • 222036-66-0

Reference: [1]Bioorganic and Medicinal Chemistry Letters,2012,vol. 22,p. 814 - 819

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

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