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Home > Encyclopedia > 3(2H)-Isoquinolinone

3(2H)-Isoquinolinone

3(2H)-Isoquinolinone structure

3(2H)-Isoquinolinone 

structure
  • CAS No:

    7651-81-2

  • Formula:

    C9H7NO

  • Chemical Name:

    3(2H)-Isoquinolinone

  • Synonyms:

    3(2H)-Isoquinolinone;3-Isoquinolinol;3(2H)-Isoquinolone;3-Hydroxyisoquinoline;2,3-Dihydroisoquinolin-3-one;14476-75-6

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

Light yellow powder

3(2H)-Isoquinolinone Basic Attributes

145.16

145.16

113230

2933499090

Characteristics

29.1

0.6

light yellow or yellow green acicular

1.3±0.1 g/cm3

195-196 °C

551.9°C at 760 mmHg

199.5±21.2 °C

1.691

Safety Information

3

22-41

26-37/39

Xn,Xi

Irritant

P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, P501

H302

|Danger|H302 (88.89%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, and P501|Aggregated GHS information provided by 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

3-hydroxyisoquinoline

Computed Properties

Molecular Weight:145.16
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:145.052763847
Monoisotopic Mass:145.052763847
Topological Polar Surface Area:29.1
Heavy Atom Count:11
Complexity:319
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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