89943-15-7 Purity
96%
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The molecular formula of cicletanine is C14H12ClNO2.
The molecular weight of cicletanine is 261.70 g/mol.
The IUPAC name of cicletanine is 3-(4-chlorophenyl)-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-7-ol.
The InChI of cicletanine is InChI=1S/C14H12ClNO2/c1-8-13(17)12-7-18-14(11(12)6-16-8)9-2-4-10(15)5-3-9/h2-6,14,17H,7H2,1H3.
The InChIKey of cicletanine is CVKNDPRBJVBDSS-UHFFFAOYSA-N.
The Canonical SMILES of cicletanine is CC1=NC=C2C(OCC2=C1O)C3=CC=C(C=C3)Cl.
The CAS number of cicletanine is 89943-82-8.
The ChEMBL ID of cicletanine is CHEMBL191886.
The Hydrogen Bond Acceptor Count of cicletanine is 3.
The Topological Polar Surface Area of cicletanine is 42.4?2.