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Chemical structure of 5-fluoro PB-22 3-carboxyindole metabolite

GC18415

5-fluoro PB-22 3-carboxyindole metabolite

Also known as 1-(5-fluoropentyl)indole-3-carboxylic acid

5-fluoro PB-22 3-carboxyindole metabolite is an analytical reference standard that is structurally categorized as a synthetic cannabinoid

ChemicalCAS1432794-98-3MW249.3FormulaC14H16FNO2
CAS number
1432794-98-3
Molecular weight
249.3
Formula
C14H16FNO2
Solubility
DMF： 30mg/ml,DMSO： 30mg/ml,DMSO：PBS(pH7·2) (1：1)： 0·5 mg/ml,Ethanol： 10 mg/ml
InChIKey
DYLIZXRQZRUDLA-UHFFFAOYSA-N
Catalogue number
GC18415
Brand
GLPBIO
Computed properties PubChem CID 86346291 · XLogP 2.9 · TPSA 42.2 Ų · H-bond donors 1
XLogP
2.9
TPSA
42.2 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
18

SMILES C1=CC=C2C(=C1)C(=CN2CCCCCF)C(=O)O

Computed descriptors from PubChem (CID 86346291), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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