기본 정보
- CAS
51553-17-4- 표준 SMILES
CCNC(C)C(=O)c1ccccc1.Cl- InChIKey
XCVDYVFUJZVVKL-UHFFFAOYSA-N- 분자식
- C11H16ClNO
- 평균 분자량
- 213.7 g/mol
- 단동위원소 질량
- 213.09204181
이름 및 식별자
- 우선 이름
- Ethcathinone hydrochloride
- IUPAC
- 2-(ethylamino)-1-phenylpropan-1-one;hydrochloride
- 현지명
- 2-(에틸아미노)프로피오페논 하이드로클로라이드
- 영어명
- 2-(Ethylamino)propiophenone hydrochloride
- 분자식
- C11H16ClNO
- 분자량
- 213.7
이름 및 동의어
2-(Ethylamino)propiophenone hydrochloride51553-17-4Ethcathinone HydrochlorideSQ59TT7X5RRMI-8201A1-Propanone, 2-(ethylamino)-1-phenyl-, hydrochloride (1:1)DTXSID10332526RefChem:592578DTXCID00283619UNII-SQ59TT7X5REthcathinone.HCl2-(ethylamino)-1-phenylpropan-1-one;hydrochloride
이름 더 보기
2-(에틸아미노)프로피오페논하이드로클로라이드RMI 8201A2-Ethylaminopropiophenone HCl(±)-N-Ethylcathinone hydrochloride(RS)-2-ethylamino-1-phenyl-propan-1-oneN-Ethylcathinone hydrochloride solution(RS)-2-ethylaMino-1-phenyl-propan-1-one HCl2-(Ethylamino)propiophenone hydrochloride 99%
ethyl-(1-oxo-1-phenylpropan-2-yl)azanium;chloride2-(Ethylamino)propiophenone Hydrochloride (1mg/ml in Acetonitrile)Ethcathinone Hydrochloride; N-Ethyl-cathinone Hydrochloride; 2-(Ethylamino)-1-phenyl-1-propanone hydrochloride; 2-(Ethylamino)propiophenone hydrochloride; RMI 8201Aalpha-Ethylaminopropiophenone, hydrochlorideEthcathinone (hydrochloride)1-Propanone, 2-(ethylamino)-1-phenyl-, hydrochlorideSCHEMBL2955041ethylaminopropiophenone hydrochloride
데이터베이스 식별자
- CAS
51553-17-4- PubChem CID
- 458518
- DTXSID
DTXSID10332526- UNII
- SQ59TT7X5R
- EC Number
- 624-972-6
물성
구조 계산 물성
- 극성 표면적
- 29.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 161
물리화학적 성질
- 녹는점
- 195 · 195-198 °C(lit.)
- 인화점
- 9 ℃ · 9℃
- 저장 조건
- Hygroscopic, Refrigerator, Under Inert Atmosphere
- 용해도
- 20 mg/ml; · DMF: 20 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml; Methanol: 1 mg/ml; PBS (pH 7.2): 10 mg/ml
- 물리적 상태
- 결정성 고체
- 주요 응용
- 법의학 및 독성학
- InChI
- 1S/C11H15NO.ClH/c1-3-12-9(2)11(13)10-7-5-4-6-8-10;/h4-9,12H,3H2,1-2H3;1H
- InChIKey
- XCVDYVFUJZVVKL-UHFFFAOYSA-N
- SMILES
- CC(NCC)C(C1=CC=CC=C1)=O.Cl
화학적 성질
White Solid
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (97.4%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (97.4%)
안전 데이터
- wgk
- 3
- ridadr
- UN1230 - class 3 - PG 2 - Methanol, solution
- risk_code
- 36/37/38-39/23/24/25-23/24/25-11
- hazard_code
- Xi,T,F
- safety_code
- 26-36-45-36/37-16-7
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2STOT SE 1
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
응용 분야
용도Ethcathinone is a metabolite of Diethylpropion. It is a cathinone derivative that produces amphetamine-like stimulus effects
일반 설명N-Ethylcathinone, or ethylpropion, is an amphetamine and stimulant drug sold along with mephedrone as “ecstasy” at parties and raves. With street names such as ETH-CAT, the illicit drug is also sold in bath salt blends across the US, Europe, and Australia. This Certified Spiking Solution is suitable as starting material in calibrators and controls for GC/MS or LC/MS bath salt testing applications in forensic analysis, urine drug testing or clinical toxicology.
관련 반응
2건
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