Vitas-M small molecule compound

2-(4-fluorophenyl)azepane

Catalog ID
STK893197
SMILES Fc1ccc(cc1)C1CCCCCN1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H16FN MW 193.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16FN/c13-11-7-5-10(6-8-11)12-4-2-1-3-9-14-12/h5-8,12,14H,1-4,9H2
InChIKey
KYRNAJNHLFLGFP-UHFFFAOYSA-N
Synonyms
168890-44-6
168890446
2(4fluorophenyl)azepane
2(4FLUOROPHENYL)HEXAHYDRO1HAZEPINE
C1CCC(NCC1)C2=CC=C(C=C2)F
InChI=1SC12H16FNc13117510(6811)12421391412h581214H149H2
MFCD02663706
ZINC000002582651
ZINC000003734856

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.