Thiocholine

HCID 37851CAS 625-00-3

基本情報

標準SMILES
C[N+](C)(C)CCS
InChIKey
VFUGTBZQGUVGEX-UHFFFAOYSA-O
分子式
C5H14NS+
平均分子量
120.24 g/mol
単同位体質量
120.08414687

概要

A mercaptocholine used as a reagent for the determination of CHOLINESTERASES. It also serves as a highly selective nerve stain.

名称と識別子

優先名称
Thiocholine
IUPAC
trimethyl(2-sulfanylethyl)azanium

名称と別名

THIOCHOLINE625-00-3DTXSID50978088RefChem:189446DTXCID501330669Ethanaminium, 2-mercapto-N,N,N-trimethyl-trimethyl(2-sulfanylethyl)azanium2-(TRIMETHYLAMMONIUM)ETHYL THIOLCHEMBL136145VFUGTBZQGUVGEX-UHFFFAOYSA-ON,N,N-TrimethylcysteamineAC55E7DP9S
名称をさらに表示
SCHEMBL135464(2-mercaptoethyl)trimethylammoniumBDBM50055164AKOS0221221172-Mercapto-N,N,N-trimethylethanaminiumDB01803N,N,N-trimethyl-2-sulfanylethanaminiumPD008414

データベース識別子

CAS
625-00-3
PubChem CID
37851
DTXSID
DTXSID50978088
ChEMBL
CHEMBL136145、CHEMBL147699
UNII
AC55E7DP9S
Nikkaji
J221.587J

物性

構造計算による物性

XLogP
0.6
極性表面積
1 Ų
水素結合供与体数
1
水素結合受容体数
1
回転可能結合数
2
重原子数
7

実験および物理化学的性質

DrugsPharmaceuticals -> Listed in ZINC15

化学と産業

薬理情報

MeSH Pharmacological Classification · 1 件

Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. Indicators are substances that change in physical appearance, e.g., color, at or approaching the endpoint of a chemical titration, e.g., on the passage between acidity and alkalinity. Reagents are substances used for the detection or determination of another substance by chemical or microscopical means, especially analysis. Types of reagents are precipitants, solvents, oxidizers, reducers, fluxes, and colorimetric reagents. (From Grant & Hackh's Chemical Dictionary, 5th ed, p301, p499)

関連反応

2 件

関連ノート

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