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Home > Encyclopedia > 5-(Aminomethyl)-3(2H)-isothiazolone

5-(Aminomethyl)-3(2H)-isothiazolone

5-(Aminomethyl)-3(2H)-isothiazolone structure

5-(Aminomethyl)-3(2H)-isothiazolone 

structure
  • CAS No:

    62020-54-6

  • Formula:

    C4H6N2OS

  • Chemical Name:

    5-(Aminomethyl)-3(2H)-isothiazolone

  • Synonyms:

    3(2H)-Isothiazolone,5-(aminomethyl)-;5-(Aminomethyl)-3(2H)-isothiazolone;Thiomuscimol

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

5-(Aminomethyl)-3(2H)-isothiazolone Basic Attributes

130.17 g/mol

130.17

DTXSID00211078

Characteristics

80.4 Ų

140 °C (decomp)

Drug Information

5-aminomethyl-3-isothiazolol

Computed Properties

Molecular Weight:130.17
XLogP3:-1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:130.02008399
Monoisotopic Mass:130.02008399
Topological Polar Surface Area:80.4
Heavy Atom Count:8
Complexity:143
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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