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Home > Encyclopedia > 2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione

2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione

2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione structure

2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione 

structure
  • CAS No:

    51132-00-4

  • Formula:

    C12H10BrNO3

  • Chemical Name:

    2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione

  • Synonyms:

    2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione;2-(4-Bromo-3-oxobutyl)-2,3-dihydro-1H-isoindole-1,3-dione;1H-Isoindole-1,3(2H)-dione, 2-(4-bromo-3-oxobutyl)-

2-(4-Bromo-3-oxobutyl)isoindoline-1,3-dione Basic Attributes

296.12

296.12

DTXSID00396036

2933998090

Characteristics

54.4

1.57460

1.614±0.06 g/cm3(Predicted)

119-120 °C

427.3±25.0 °C(Predicted)

212.2ºC

1.614

-2.29±0.20(Predicted)

under inert gas (nitrogen or Argon) at 2-8°C

Safety Information

UN 3077 9 / PGIII

3

Xn

36/37

Xn

P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, P501

43-52

UN 3077 9 / PGIII

|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:296.12
XLogP3:1.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:294.98441
Monoisotopic Mass:294.98441
Topological Polar Surface Area:54.4
Heavy Atom Count:17
Complexity:332
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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