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Home > Encyclopedia > 1-pentyl-1H-indole-3-carboxylicacid

1-pentyl-1H-indole-3-carboxylicacid

1-pentyl-1H-indole-3-carboxylicacid structure

1-pentyl-1H-indole-3-carboxylicacid 

structure
  • CAS No:

    727421-73-0

  • Formula:

    C14H17NO2

  • Chemical Name:

    1-pentyl-1H-indole-3-carboxylicacid

  • Synonyms:

    1-pentyl-1H-indole-3-carboxylic acid;1-pentylindole-3-carboxylic acid;PB-22 3-carboxyindole metabolite;PB-22 3-carboxyindole metabolite solution;PB-22 3-carboxyindol metabolite;1H-Indole-3-carboxylic acid, 1-pentyl-

1-pentyl-1H-indole-3-carboxylicacid Basic Attributes

231.29

231.125928785

2933990090

Characteristics

42.23000

3.52970

1.12±0.1 g/cm3

418.3±18.0 °C(Predicted)

4.01±0.10

Safety Information

UN 1648 3 / PGII

1-pentyl-1H-indole-3-carboxylicacid Use and Manufacturing

PB-22 is an analog of the potent synthetic cannabinoid, JWH 018 , which differs by having 8-hydroxyquinoline replacing the naphthalene group of JWH 018. PB-22 3-carboxyindole metabolite is expected to be a metabolite of PB-22 that would be detectable both in serum and urine. The physiological and toxicological properties of this compound are not known. This product is intended for forensic and research applications.

Computed Properties

Molecular Weight:231.29
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:231.125928785
Monoisotopic Mass:231.125928785
Topological Polar Surface Area:42.2
Heavy Atom Count:17
Complexity:267
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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