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Home > Encyclopedia > 5-Amino-1(2H)-isoquinolinone

5-Amino-1(2H)-isoquinolinone

5-Amino-1(2H)-isoquinolinone structure

5-Amino-1(2H)-isoquinolinone 

structure
  • CAS No:

    93117-08-9

  • Formula:

    C9H8N2O

  • Chemical Name:

    5-Amino-1(2H)-isoquinolinone

  • Synonyms:

    1(2H)-Isoquinolinone,5-amino-;Isocarbostyril,5-amino-;5-Amino-1(2H)-isoquinolinone;5-Amino-2H-isoquinolin-1-one

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

5-amino-2H-isoquinolin-1-one is a member of isoquinolines.

5-Amino-1(2H)-isoquinolinone Basic Attributes

160.17262

160.17

DTXSID90274354

2933790090

Characteristics

55.1

0.7

1.287

477.3±45.0°C at 760 mmHg

242.4±28.7 °C

1.657

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

5-AIQ

5-Amino-1(2H)-isoquinolinone Use and Manufacturing

268.3 mg (1.51 mmol) of 5-nitroisoquinolin-1(2H)-one is added with 376.5 mg of ammonium chloride and 2.6 ml of water in 14 ml of ethanol and 5.4 ml of tetrahydrofuran.

Computed Properties

Molecular Weight:160.17
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:160.063662883
Monoisotopic Mass:160.063662883
Topological Polar Surface Area:55.1
Heavy Atom Count:12
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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