Acetylthiocholine iodide (HCID 74629)

이름 및 식별자

우선 이름: Acetylthiocholine iodide
IUPAC: 2-acetylsulfanylethyl(trimethyl)azanium iodide
현지명: 아세틸티오콜린요오드화물
영어명: Acetylthiocholine iodide
분자식: C7H16INOS
분자량: 289.18

이름 및 동의어

Acetylthiocholine iodide1866-15-5S-Acetylthiocholine iodide2-Acetylthioethyltrimethylammonium iodide6SKH6P4YRNNSC-44139Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodide (1:1)DTXSID50883764RefChem:109203DTXCID701023254217-474-1Acetylthiocholine diiodide

이름 더 보기

아세틸티오콜린요오드화물Acetylthiocholine ioAcetylthiocholinjodidacetylthiocholine iodieKamovsky-roots solutionIodine thioacetylcholineIodide thioacetylcholines-acetylthio-choliniodideacetylthiocholinediiodideacethylthiocholine iodide

Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodideMFCD000118192-(Acetylthio)-N,N,N-trimethylethanaminium iodideC7H16INOSNSC 44139(2-Mercaptoethyl)trimethylammonium iodide acetate((2-Mercaptoethyl)trimethylammonium iodide acetate)2-(Acetylthio)-N,N,N-trimethylethan-1-aminium iodide

데이터베이스 식별자

CAS: 1866-15-5
PubChem CID: 74629
DTXSID: DTXSID50883764
UNII: 6SKH6P4YRN
EC Number: 217-474-1

물성

구조 계산 물성

극성 표면적: 42.4 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 11
형식 전하: 0
복잡도: 117

물리화학적 성질

녹는점: 205 · 205-210 °C(lit.)
밀도: 1.4885 · 1.4885 (estimate)
저장 조건: 2 · 2-8°C
용해도: 2 O: · H2O: 100 mg/mL
물리적 상태: 가루
색상: 하얀색
수용성: 2 O: · H2O: 100mg/mL
BRN: 3916578 · 3916578
InChI: InChI=1S/C7H16NOS.HI/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey: NTBLZMAMTZXLBP-UHFFFAOYSA-M
SMILES: [N+](C)(C)(C)CCSC(=O)C.[I-]
EPA: 2 · Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodide (1866-15-5)

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H311 (97.9%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 2건

Chemical: Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodide

2-Acetylthioethyltrimethylammonium iodide: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 3 (100%)；Acute Tox. 3 (97.9%)；Skin Irrit. 2 (97.9%)；Eye Irrit. 2 (97.9%)；STOT SE 3 (95.8%)

규제 정보

Regulatory Information · 2건

Chemical: Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodide

2-Acetylthioethyltrimethylammonium iodide: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: FZ9865000
ridadr: UN 2811 6.1/PG 3
HS 번호: 29309099
risk_code: 21-25-36/37/38
hazard_code: T,Xi
safety_code: 26-36
포장분류: III
위험 등급: 6.1
F 고인화성물질: 3-8-10
Hazard Classifications: Acute Tox. 3 DermalAcute Tox. 3 Oral
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

용도 및 제조

General Manufacturing InformationEthanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodide (1:1): ACTIVE

응용 분야 · 2건

개요Acetylthiocholine iodide, also known as ATCI, serves as both an acetylcholinesterase (AChE) substrate and a nicotinic acetylcholine receptor (AChR) agonist. ATCI itself is a colorless and odorless compound. It exhibits solubility in both water and ethanol. It is a synthetic compound extensively employed in laboratory experiments to measure the activity of AChE, a vital enzyme responsible for the breakdown of the neurotransmitter acetylcholine (ACh) in the central and peripheral nervous systems. Additionally, it enables the evaluation of drug effects on AChE activity and facilitates investigations into the impact of toxins on the nervous system. Acetylthiocholine iodide functions as an inhibitor of AChE. By binding to the enzyme′s active site, it prevents AChE from catalyzing the breakdown of ACh. Consequently, ACh accumulates in the synaptic cleft, leading to increased neuron excitability. This inhibition of AChE by ATCI ultimately results in a higher ACh concentration within the synaptic cleft, yielding a range of physiological effects. These effects encompass heightened muscle contraction, increased heart rate and blood pressure, elevated salivation, intensified bronchial secretions, and augmented gastrointestinal activity[1].

용도Acetylthiocholine iodide has been used as a substrate in the preparation of acetylcholine esterase (AChE) assay working solution for AChE activity assay. It has also been used as a component in phosphate buffer (PB) for cholinesterase assay.

상·하류 제품 정보

상류 원료

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Suzhou Victorypharm Co.,Ltd.+86-13916956214 · [email protected]

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