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C001

Sigma-Aldrich

Acetylethylcholine mustard hydrochloride

>97% (GC), powder

Sinônimo(s):

Acetyl AF-64

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About This Item

Fórmula empírica (Notação de Hill):
C8H16ClNO2 · HCl
Número CAS:
103994-00-9
Peso molecular:
230.13
Número MDL:
MFCD00055153
Código UNSPSC:
12352200
ID de substância PubChem:
329774756
NACRES:
NA.77

Nível de qualidade

100

Ensaio

>97% (GC)

forma

powder

condição de armazenamento

desiccated

cor

white

pf

78-81  °C

solubilidade

H2O: >5 mg/mL
ethanol: soluble
methanol: soluble

temperatura de armazenamento

−20°C

cadeia de caracteres SMILES

Cl[H].CCN(CCCl)CCOC(C)=O

InChI

1S/C8H16ClNO2.ClH/c1-3-10(5-4-9)6-7-12-8(2)11;/h3-7H2,1-2H3;1H

chave InChI

CHWPASAPXMNLKO-UHFFFAOYSA-N

Aplicação

Acetylethylcholine mustard hydrochloride has been used as a precursor in ethylcholine aziridinium (AF64A) preparation. It has also been used in the pharmacokinetic study to investigate its role in neuromuscular junction (NMJ) signal transmission and function.

Ações bioquímicas/fisiológicas

Acetylethylcholine mustard hydrochloride can reduce the contraction frequency of the myotubes by inhibiting the synthesis of acetylethylcholine (Ach) with the half-maximal inhibitory concentration (IC50) of 1.22 mM.
Acetylethylcholine mustard is a precursor for ethylcholine mustard aziridinium ion (AF-64A); irreversible ligand for the high affinity choline transport system; specific presynaptic long action cholinotoxin; inhibitor of choline acetyl-transferase.

Atenção

Extremely hygroscopic.

Pictogramas

Skull and crossbonesHealth hazard
GHS06,GHS08

Palavra indicadora

Danger

Classificações de perigo

Acute Tox. 2 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 2 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 1 - STOT SE 3

Órgãos-alvo

Nervous system, Respiratory system

Código de classe de armazenamento

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

204.8 °F - closed cup

Ponto de fulgor (°C)

96 °C - closed cup

Certificados de análise (COA)

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