Vitas-M small molecule compound

1'-(chloromethyl)-4'H-spiro[cyclohexane-1,3'-isoquinoline]

Catalog ID
STK839937
SMILES ClCC1=NC2(CCCCC2)Cc2c1cccc2

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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 C15H18ClN MW 247.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18ClN/c16-11-14-13-7-3-2-6-12(13)10-15(17-14)8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-11H2
InChIKey
IMENUSUCFACGNM-UHFFFAOYSA-N
Synonyms

1(chloromethyl)4Hspiro(cyclohexane13isoquinoline)
1(chloromethyl)4Hspiro(cyclohexane13isoquinoline)hydrochloride
1(CHLOROMETHYL)SPIRO(4HISOQUINOLINE31CYCLOHEXANE)
1CHLOROMETHYL3SPIROCYCLOHEXYL34DIHYDROISOQUINOLINE
C1CCC2(CC1)CC3=CC=CC=C3C(=N2)CCl
ClCC1=NC2(CCCCC2)Cc2c1cccc2Cl
InChI=1SC15H18ClNc16111413732612(13)1015(1714)8415915h2367H145811H2
MFCD02163736
ZINC000000210276
ZINC00210276
ZINC210276

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Available files

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