CAS 61655-58-1 MK-212 hydrochloride (HCID 198421)

기본 정보

CAS: 61655-58-1
표준 SMILES: Cl.Clc1cncc(N2CCNCC2)n1
InChIKey: PFIZGLUIYAZQFU-UHFFFAOYSA-N
분자식: C8H12Cl2N4
평균 분자량: 235.11 g/mol
단동위원소 질량: 234.04390174

이름 및 식별자

우선 이름: MK-212 hydrochloride
IUPAC: 2-chloro-6-piperazin-1-ylpyrazine;hydrochloride
현지명: 2-클로로-6-(1-피페라지닐)피라진모노하이드로클로라이드
영어명: 2-chloro-6-(1-piperazinyl)pyrazine monohydrochloride
분자식: C8H12Cl2N4
분자량: 235.11368

이름 및 동의어

61655-58-1MK-212 hydrochlorideMK-212 HCl67250-10-6EINECS 262-883-0UNII-8722D514RX1-(6-Chloro-2-pyrazinyl)piperazine monohydrochlorideDTXSID60210668Pyrazine, 2-chloro-6-(1-piperazinyl)-, monohydrochloride8722D514RXMK-212-HCLPyrazine, 2-chloro-6-(1-piperazinyl)-, hydrochloride

이름 더 보기

2-클로로-6-(1-피페라지닐)피라진모노하이드로클로라이드NSC 31732MK-212 (monohydrochloride)MK-212 hydrochloride >=98% (HPLC)MK 212 hydrochloride, 5-HT2C receptor agonist2-Chloro-6-(1-piperazinyl)-pyrazine hydrochloride5-HT Receptor,5-hydroxytryptamine Receptor,Inhibitor,Serotonin Receptor,MK 212 hydrochloride,MK-212 monohydrochloride,inhibit,CPP monohydrochloride

PYRAZINE, 2-CHLORO-6-(1-PIPERAZINYL)-, HYDROCHLORIDE (1:1)RefChem:159189DTXCID90133159262-883-0684-705-4MK 212 HYDROCHLORIDE2-chloro-6-(piperazin-1-yl)pyrazine hydrochloride2-Chloro-6-(1-piperazinyl)pyrazine monohydrochloride

데이터베이스 식별자

CAS: 61655-58-1、67250-10-6
PubChem CID: 198421
DTXSID: DTXSID60210668
ChEMBL: CHEMBL3250751
UNII: 8722D514RX
EC Number: 262-883-0、684-705-4

물성

구조 계산 물성

극성 표면적: 41.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 160

물리화학적 성질

저장 조건: 2 · Inert atmosphere,2-8°C
용해도: 20 mg/mL · DMSO: ≥20mg/mL
물리적 상태: 가루
색상: 흰색에서 황백색까지
수용성: 50 mM · Soluble to 50 mM in water with gentle warming
InChI: 1S/C8H11ClN4.ClH/c9-7-5-11-6-8(12-7)13-3-1-10-2-4-13;/h5-6,10H,1-4H2;1H
InChIKey: PFIZGLUIYAZQFU-UHFFFAOYSA-N
SMILES: Cl.Clc1cncc(n1)N2CCNCC2

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

유해성 정보

Hazard Classes and Categories · 2건

Acute Tox. 3 (100%)

Acute Tox. 4 (100%)

안전 데이터

wgk: 3
ridadr: UN 2811 6.1 / PGIII
risk_code: 25
hazard_code: T
safety_code: 45
Hazard Classifications: Acute Tox. 3 Oral
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야

용도MK 212 Hydrochloride is a 5-HT2C agonist that may possess antipsychotic activity; however, mainly functions as an anti-stress treatment when ingested.