Vitas-M small molecule compound

1-(3-phenylprop-2-yn-1-yl)azepane

Catalog ID
STK946038
SMILES C1CCCCN(C1)CC#Cc1ccccc1

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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 C15H19N MW 213.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N/c1-2-7-13-16(12-6-1)14-8-11-15-9-4-3-5-10-15/h3-5,9-10H,1-2,6-7,12-14H2
InChIKey
AUHMVYQLZBFPFI-UHFFFAOYSA-N
Synonyms

(3PHENYLPROP2YNYL)AZAPERHYDROEPINE
1(3phenylprop2yn1yl)azepane
1(3phenylprop2yn1yl)azepanehydrochloride
1(3PHENYLPROP2YNYL)AZEPANE
C1CCCCN(C1)CC#Cc1ccccc1Cl
C1CCCN(CC1)CC#CC2=CC=CC=C2
InChI=1SC15H19Nc1271316(1261)148111594351015h35910H12671214H2
MFCD00652969
ZINC000001225582
ZINC1225582

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Available files

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