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Vitas-M small molecule compound

N-benzyl-N,N-dimethyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy}ethanaminium

Catalog ID
STL256857
SMILES CC(CC(c1ccc(cc1)OCCOCC[N+](Cc1ccccc1)(C)C)(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 C27H42NO2 MW 412.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H42NO2/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23/h8-16H,17-22H2,1-7H3/q+1
InChIKey
SIYLLGKDQZGJHK-UHFFFAOYSA-N
Synonyms
10172-60-8
10172608
2(2(4DIISOBUTYLPHENOXY)ETHOXY)ETHYL)DIMETHYLBENZYLAMMONIUMCHLORIDE
ANTISEPTOL(QUARTERNARYCOMPOUND)
BENCETONIUMCHLORIDE
BENZATHONIUMCHLORIDE
BENZETHONIICHLORIDUM(INNLATIN)
BENZETHONIUM
BENZETHONIUMCHLORIDE(USANINNBANJAN)
BENZETHONIUMHYDROCHLORIDE
BENZETHONIUMHYDROXIDE
BENZETHONIUMHYDROXIDESOLUTION1MINMETHANOL
BENZYLDIMETHYL(2(2(4(244TRIMETHYLPENTAN2YL)PHENOXY)ETHOXY)ETHYL)AZANIUM
CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC(N+)(C)(C)CC2=CC=CC=C2
CC(CC(c1ccc(cc1)OCCOCC(N+)(Cc1ccccc1)(C)C)(C)C)(C)C
CHLORUREDEBENZETHONIUM(INNFRENCH)
DIISOBUTYLPHENOXYETHOXYETHYLDIMETHYLBENZYLAMMONIUMCHLORIDE
InChI=1SC27H42NO2c126(23)2227(45)24131525(161424)30201929181728(67)21231198101223h816H1722H217H3q+1
MFCD00133119
NbenzylNNdimethyl2(2(4(244trimethylpentan2yl)phenoxy)ethoxy)ethanaminium
OCTYLPHENOXYETHOXYETHYLDIMETHYLBENZYLAMMONIUMCHLORIDE
PDIISOBUTYLPHENOXYETHOXYETHYLDIMETHYLBENZYLAMMONIUMCHLORIDE
PHEMERSOLCHLORIDE
SOLAMIN
SOLAMINE
ZINC000001571009
ZINC01571009
ZINC1571009

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Available files

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