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Structure

1H-Isoindol-1-one,5-bromo-2,3-dihydro-2-methyl-

CAS
868066-91-5
Catalog Number
ACM868066915
Category
Other Products
Molecular Weight
226.07
Molecular Formula
C9H8 Br N O

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Specification

Synonyms
5-bromo-2-methylisoindolin-1-one, 868066-91-5, SureCN290250, CTK8C4616, ANW-72476, ZINC45328696, AKOS015855549, RP27641, AK-37748, KB-73326, ST51056137, S10-0049
IUPAC Name
5-bromo-2-methyl-3H-isoindol-1-one
Canonical SMILES
CN1CC2=C(C1=O)C=CC(=C2)Br
InChI Key
WRFZBWHXIGUNLQ-UHFFFAOYSA-N
Boiling Point
356.2ºC at 760 mmHg
Flash Point
169.2ºC
Density
1.589g/cm³
Exact Mass
224.97900
H-Bond Acceptor
1
H-Bond Donor
0

Upstream Synthesis Route 1

  • 74-89-5
  • 78471-43-9
  • 868066-91-5

Reference: [1] Patent: WO2016/51193, 2016, A1, . Location in patent: Paragraph 00527; 00530; 00531

Upstream Synthesis Route 2

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

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

Upstream Synthesis Route 3

  • 888030-79-3
  • 868066-91-5

Reference: [1] Patent: WO2008/8539, 2008, A2, . Location in patent: Page/Page column 102

Upstream Synthesis Route 4

  • 888030-79-3
  • 868066-91-5

Reference: [1]Patent: WO2008/8539,2008,A2 .Location in patent: Page/Page column 102

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