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6-(Triethylammonium)hexyl Methanethiosulfonate Bromide

HCID 46783166
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Basic information

CAS
386229-78-3
Standard SMILES
CC[N+](CC)(CC)CCCCCCSS(C)(=O)=O.[Br-]
InChIKey
NMTKONNSRKDPBO-UHFFFAOYSA-M
Molecular formula
C13H30BrNO2S2
Average molar mass
376.4 g/mol
Monoisotopic mass
375.09013

Names & identifiers

Preferred name
6-(Triethylammonium)hexyl Methanethiosulfonate Bromide
IUPAC
triethyl(6-methylsulfonylsulfanylhexyl)azanium bromide
English name
6-(Triethylammonium)hexyl methanethiosulfonate bromide
Molecular formula
C13H30BrNO2S2
Molecular weight
376.42

Names & synonyms

386229-78-36-(Triethylammonium)hexyl Methanethiosulfonate Bromidetriethyl(6-methylsulfonylsulfanylhexyl)azanium;bromideC13H30BrNO2S2DTXSID90676172MFCD01320469AKOS025295270triethyl(6-methylsulfonylsulfanylhexyl)ammonium;bromideN,N,N-Triethyl-6-[(methanesulfonyl)sulfanyl]hexan-1-aminium bromideMTS-TEAHN,N,N-Triethyl-6-[(Methylsulfonyl)thio]-MTS-TEAH [6-(Triethylammonium)hexyl methanethiosulfonate bromide
Show more names
N,N,N-Triethyl-6-[(methylsulfonyl)thio]-1-hexanaminiumbromide Bromide1-Hexanaminium, N,N,N-triethyl-6-[(methylsulfonyl)thio]-, bromide (1:1)

Database identifiers

CAS
386229-78-3
PubChem CID
46783166
DTXSID
DTXSID90676172

Properties

Computed structural properties

Topological polar surface area
67.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
19
Formal charge
0
Complexity
284

Physicochemical properties

storage temp.
-20 °C · -20°C Freezer
solubility
DMSO (Slightly), Methanol (Slightly)
form
Solid
color
White to Off-White

Chemistry & industry

Applications · 2 items

Uses6-(TRIETHYLAMMONIUM)HEXYL METHANETHIOSULFONATE BROMIDE is a water soluble, bulkier analogue of the charged MTS reagent MTSET. 6-(TRIETHYLAMMONIUM)HEXYL METHANETHIOSULFONATE BROMIDE have been used successfully with SCAM (substituted cysteine accessibility method) to probe the topology and fu nction of a number of ligand-gated ion channels and transporter proteins.

UsesA water soluble, bulkier analogue of the charged MTS reagent MTSET. Charged MTS reagents have been used successfully with SCAM (substituted cysteine accessibility method) to probe the topology and function of a number of ligand-gated ion channels and transporter proteins.

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