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Chemical structure of methyl-1-pentyl-1H-indole-3-Carboxylate

GC41561

methyl-1-pentyl-1H-indole-3-Carboxylate

Also known as methyl 1-pentylindole-3-carboxylate

PB-22 is synthetic cannabinoid that has been identified in herbal mixtures

ChemicalCAS1338925-20-4MW245.3FormulaC15H19NO2
CAS number
1338925-20-4
Molecular weight
245.3
Formula
C15H19NO2
Solubility
DMF: 16 mg/ml,DMSO: 16 mg/ml,DMSO:PBS(pH 7·2) (1:3): 0·25 mg/ml,Ethanol: 12·5 mg/ml
InChIKey
FMSUKWLGFFSMTP-UHFFFAOYSA-N
Catalogue number
GC41561
Brand
GLPBIO
Computed properties PubChem CID 56642542 · XLogP 3.6 · TPSA 31.2 Ų · H-bond donors 0
XLogP
3.6
TPSA
31.2 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
18

SMILES CCCCCN1C=C(C2=CC=CC=C21)C(=O)OC

Computed descriptors from PubChem (CID 56642542), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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