Vitas-M small molecule compound

N-benzyl-N,N,2-trimethyl-2-(4,4,6-trimethyl-1,3-dioxan-2-yl)propan-1-aminium

Catalog ID
STK063672
SMILES CC1OC(OC(C1)(C)C)C(C[N+](Cc1ccccc1)(C)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 C20H34NO2 MW 320.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H34NO2/c1-16-13-20(4,5)23-18(22-16)19(2,3)15-21(6,7)14-17-11-9-8-10-12-17/h8-12,16,18H,13-15H2,1-7H3/q+1
InChIKey
YNHRDZNKRQDHKG-UHFFFAOYSA-N
Synonyms

BENZYLDIMETHYL(2METHYL2(446TRIMETHYL(13)DIOXAN2YL)PROPYL)AMMONIUM
BENZYLDIMETHYL(2METHYL2(446TRIMETHYL13DIOXAN2YL)PROPYL)AZANIUM
CC1CC(OC(O1)C(C)(C)C(N+)(C)(C)CC2=CC=CC=C2)(C)C
CC1OC(OC(C1)(C)C)C(C(N+)(Cc1ccccc1)(C)C)(C)C
CC1OC(OC(C1)(C)C)C(C(N+)(Cc1ccccc1)(C)C)(C)C(Cl)
InChI=1SC20H34NO2c1161320(45)2318(2216)19(23)1521(67)14171198101217h8121618H1315H217H3q+1
MFCD00632215
NBENZYLNN2TRIMETHYL2(446TRIMETHYL13DIOXAN2YL)PROPAN1AMINIUM
NbenzylNN2trimethyl2(446trimethyl13dioxan2yl)propan1aminiumchloride
STK063672
ZINC000000238650
ZINC000000238656

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Available files

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