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Home > Encyclopedia > 1H-Benzotriazole-1-propanoic acid

1H-Benzotriazole-1-propanoic acid

1H-Benzotriazole-1-propanoic acid structure

1H-Benzotriazole-1-propanoic acid 

structure
  • CAS No:

    654-15-9

  • Formula:

    C9H9N3O2

  • Chemical Name:

    1H-Benzotriazole-1-propanoic acid

  • Synonyms:

    1H-Benzotriazole-1-propanoic acid;1H-Benzotriazole-1-propionic acid;β-(1-Benzotriazolyl)propionic acid;1-(Carboxyethyl)benzotriazole;1-Benzotriazolepropanoic acid;3-(Benzotriazol-1-yl)propionic acid;3-(Benzotriazol-1-yl)propanoic acid;3-(1H-Benzotriazol-1-yl)propanoic acid

1H-Benzotriazole-1-propanoic acid Basic Attributes

191.19

191.19

DTXSID90340280

2933990090

Characteristics

68.01000

0.90600

1.41g/cm3

433.4ºC at 760 mmHg

215.9ºC

1.673

14.2 [ug/mL]

Safety Information

IRRITANT

22-41

Xi,Xn

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

Computed Properties

Molecular Weight:191.19
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:191.069476538
Monoisotopic Mass:191.069476538
Topological Polar Surface Area:68
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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