Vitas-M small molecule compound

N,N,N,2-tetramethyl-3-{[(5-methyl-1-benzofuran-2-yl)carbonyl]oxy}butan-1-aminium

Catalog ID
STK080341
SMILES CC(C(OC(=O)c1cc2c(o1)ccc(c2)C)C)C[N+](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 C18H26NO3 MW 304.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26NO3/c1-12-7-8-16-15(9-12)10-17(22-16)18(20)21-14(3)13(2)11-19(4,5)6/h7-10,13-14H,11H2,1-6H3/q+1
InChIKey
VMZWJCHJSKWMBF-UHFFFAOYSA-N
Synonyms

(2S3R)NNN2TETRAMETHYL3(((5METHYL1BENZOFURAN2YL)CARBONYL)OXY)BUTAN1AMINIUM
(2S3S)NNN2TETRAMETHYL3(((5METHYL1BENZOFURAN2YL)CARBONYL)OXY)BUTAN1AMINIUM
CC(C(OC(=O)c1cc2c(o1)ccc(c2)C)C)C(N+)(C)(C)C
CC(C(OC(=O)c1cc2c(o1)ccc(c2)C)C)C(N+)(C)(C)C(I)
CC1=CC2=C(C=C1)OC(=C2)C(=O)OC(C)C(C)C(N+)(C)(C)C
InChI=1SC18H26NO3c112781615(912)1017(2216)18(20)2114(3)13(2)1119(45)6h7101314H11H216H3q+1
MFCD01546147
NNN2TETRAMETHYL3(((5METHYL1BENZOFURAN2YL)CARBONYL)OXY)BUTAN1AMINIUM
NNN2tetramethyl3((5methylbenzofuran2carbonyl)oxy)butan1aminiumiodide
STK080341
TRIMETHYL(2METHYL3(5METHYL1BENZOFURAN2CARBONYL)OXYBUTYL)AZANIUM
ZINC000001823600
ZINC000001823603

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Available files

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