Vitas-M small molecule compound

2-ethoxy-2-(hex-1-yn-1-yl)-1,7,7-trimethylbicyclo[2.2.1]heptane

Catalog ID
STK092900
SMILES CCCCC#CC1(OCC)CC2C(C1(C)CC2)(C)C

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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 C18H30O MW 262.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H30O/c1-6-8-9-10-12-18(19-7-2)14-15-11-13-17(18,5)16(15,3)4/h15H,6-9,11,13-14H2,1-5H3
InChIKey
UKJZUJXPHOFOKR-UHFFFAOYSA-N
Synonyms

2ETHOXY2(HEX1YN1YL)177TRIMETHYLBICYCLO(221)HEPTANE
3ETHOXY3HEX1YNYL477TRIMETHYLBICYCLO(221)HEPTANE
CCCCC#CC1(CC2CCC1(C2(C)C)C)OCC
CCCCC#CC1(OCC)CC2C(C1(C)CC2)(C)C
InChI=1SC18H30Oc1689101218(1972)1415111317(185)16(153)4h15H69111314H215H3
MFCD11851122
STK092900
ZINC000226152973
ZINC000226152983

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Available files

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