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5-butyl-1H-benzotriazole

5-butyl-1H-benzotriazole structure

5-butyl-1H-benzotriazole 

structure
  • CAS No:

    3663-24-9

  • Formula:

    C10H13N3

  • Chemical Name:

    5-butyl-1H-benzotriazole

  • Synonyms:

    5-butyl-1H-benzotriazole;5-Butylbenzotriazole;5-n-Butylbenzotriazole;5-Butyl-1H-benzo[d][1,2,3]triazole

  • Categories:

    Chemical Reagents  >  Organic Reagents

5-butyl-1H-benzotriazole Basic Attributes

175.23032

175.110947

2933990090

Characteristics

41.6

2.9

1.136±0.06 g/cm3 (20 ºC 760 Torr)

75℃ (ligroine )

174.1±12.2 °C

1.611

H2O: Very slightly soluble (0.96 g/L) (25 ºC)

5-butyl-1H-benzotriazole Use and Manufacturing

4 - n - butyl ortho - phenylenediamine, water, sodium nitriteAdd the autoclave, start stirring, heating, temperature control at 250 C, pressure 4. 8Mpa, reaction 2. 5 hours, cooling, extractAcidification with acidifier to PH4. 2, extracted with extractant, organic layer combined, recovery of solvent, vacuum distillation, collecting fractions to be5 - n - butyl - 1H - benzotriazole.

Computed Properties

Molecular Weight:175.23
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:175.110947427
Monoisotopic Mass:175.110947427
Topological Polar Surface Area:41.6
Heavy Atom Count:13
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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