Vitas-M small molecule compound

2-ethynyl-2-methyl-6-phenyl-5-(prop-1-en-2-yl)tetrahydro-2H-pyran

Catalog ID
STK066357
SMILES C#CC1(C)CCC(C(O1)c1ccccc1)C(=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 C17H20O MW 240.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20O/c1-5-17(4)12-11-15(13(2)3)16(18-17)14-9-7-6-8-10-14/h1,6-10,15-16H,2,11-12H2,3-4H3
InChIKey
KMULJELYGAFWKQ-UHFFFAOYSA-N
Synonyms
320784-75-6
(2S5R6S)2ETHYNYL2METHYL6PHENYL5(PROP1EN2YL)TETRAHYDRO2HPYRAN
2ETHYNYL2METHYL6PHENYL5(PROP1EN2YL)TETRAHYDRO2HPYRAN
2ETHYNYL2METHYL6PHENYL5PROP1EN2YLOXANE
2ETHYNYL5ISOPROPENYL2METHYL6PHENYLTETRAHYDROPYRAN
320784756
C#CC1(C)CCC(C(O1)c1ccccc1)C(=C)C
CC(=C)C1CCC(OC1C2=CC=CC=C2)(C)C#C
InChI=1SC17H20Oc1517(4)121115(13(2)3)16(1817)1497681014h16101516H21112H234H3
MFCD00298147
STK066357
ZINC000002083351
ZINC000100823735

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Available files

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