727421-73-0

727421-73-0 structure
727421-73-0 structure
  • Name: 1-Pentyl-1H-indole-3-carboxylic acid
  • Chemical Name: PB-22 3-carboxyindole metabolite
  • CAS Number: 727421-73-0
  • Molecular Formula: C14H17NO2
  • Molecular Weight: 231.290
  • Create Date: 2018-09-21 07:47:49
  • Modify Date: 2024-01-08 11:09:30

Name PB-22 3-carboxyindole metabolite
Synonyms 1H-Indole-3-carboxylic acid, 1-pentyl-
1-pentyl-1,3-dihydro-imidazole-2-thione
3-carboxy-1-pentyl-1H-indole
1-pentylindole-3-carboxylic acid
1-Pentylimidazol-2-thiol
1-Pentyl-1H-indole-3-carboxylic acid
Density 1.1±0.1 g/cm3
Boiling Point 418.3±18.0 °C at 760 mmHg
Molecular Formula C14H17NO2
Molecular Weight 231.290
Flash Point 206.8±21.2 °C
Exact Mass 231.125931
PSA 42.23000
LogP 4.34
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.570
HS Code 2933990090

~49%

727421-73-0 structure

727421-73-0

Literature: Randox Laboratories Ltd.; Fitzgerald, Stephen Peter; Innocenzi, Paul John; Lowry, Philip Andrew; McConnell, Ivan Robert; Benchikh, Elouard Patent: EP2698385 A1, 2014 ; Location in patent: Page/Page column ;

~74%

727421-73-0 structure

727421-73-0

Literature: Banister, Samuel D.; Wilkinson, Shane M.; Longworth, Mitchell; Stuart, Jordyn; Apetz, Nadine; English, Katrina; Brooker, Lance; Goebel, Catrin; Hibbs, David E.; Glass, Michelle; Connor, Mark; McGregor, Iain S.; Kassiou, Michael ACS Chemical Neuroscience, 2013 , vol. 4, # 7 p. 1081 - 1092

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727421-73-0 structure

727421-73-0

Literature: Blaazer, Antoni R.; Lange, Jos H.M.; Van Der Neut, Martina A.W.; Mulder, Arie; Den Boon, Femke S.; Werkman, Taco R.; Kruse, Chris G.; Wadman, Wytse J. European Journal of Medicinal Chemistry, 2011 , vol. 46, # 10 p. 5086 - 5098

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727421-73-0 structure

727421-73-0

Literature: Banister, Samuel D.; Wilkinson, Shane M.; Longworth, Mitchell; Stuart, Jordyn; Apetz, Nadine; English, Katrina; Brooker, Lance; Goebel, Catrin; Hibbs, David E.; Glass, Michelle; Connor, Mark; McGregor, Iain S.; Kassiou, Michael ACS Chemical Neuroscience, 2013 , vol. 4, # 7 p. 1081 - 1092

~%

727421-73-0 structure

727421-73-0

Literature: Banister, Samuel D.; Wilkinson, Shane M.; Longworth, Mitchell; Stuart, Jordyn; Apetz, Nadine; English, Katrina; Brooker, Lance; Goebel, Catrin; Hibbs, David E.; Glass, Michelle; Connor, Mark; McGregor, Iain S.; Kassiou, Michael ACS Chemical Neuroscience, 2013 , vol. 4, # 7 p. 1081 - 1092

~%

727421-73-0 structure

727421-73-0

Literature: Blaazer, Antoni R.; Lange, Jos H.M.; Van Der Neut, Martina A.W.; Mulder, Arie; Den Boon, Femke S.; Werkman, Taco R.; Kruse, Chris G.; Wadman, Wytse J. European Journal of Medicinal Chemistry, 2011 , vol. 46, # 10 p. 5086 - 5098
HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%