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N,N-Dimethylaminoethyl chloride hydrochloride

HCID 11636816
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기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
4584-46-7
표준 SMILES
CN(C)CCCl.Cl
InChIKey
LQLJZSJKRYTKTP-UHFFFAOYSA-N
분자식
C4H11Cl2N
평균 분자량
144.04 g/mol
단동위원소 질량
143.0268547

이름 및 식별자

우선 이름
N,N-Dimethylaminoethyl chloride hydrochloride
IUPAC
2-chloro-N,N-dimethylethanamine;hydrochloride

이름 및 동의어

4584-46-72-Chloro-N,N-dimethylethylamine hydrochloride(2-Chloroethyl)dimethylamine hydrochloride2-(Dimethylamino)ethyl chloride hydrochlorideDimethylaminoethyl chloride hydrochlorideN,N-Dimethylaminoethyl chloride hydrochlorideN,N-Dimethyl-2-chloroethylamine hydrochlorideDTXSID70521092-Dimethylaminochloroethane hydrochlorideHE7Z9G0YMAN-(2-Chloroethyl)-N,N-dimethylammonium chloridebeta-CHLOROETHYLDIMETHYLAMINE HCl
이름 더 보기
NSC-111230N,N-Dimethyl-N-(2-chloroethyl)amine hydrochloride2-Chloroethyl dimethyl ammonium chlorideChloro(dimethylamino)ethane hydrochlorideDimethyl(2-chloroethyl)amine hydrochlorideDTXCID9030678(2-Chloroethyl)dimethylamine monohydrochloride2-Chloroethyldimethylammonium chloride

데이터베이스 식별자

CAS
4584-46-7
PubChem CID
11636816
DTXSID
DTXSID7052109
ChEMBL
CHEMBL3561603
ChEBI
CHEBI:78153
UNII
HE7Z9G0YMA
EC Number
224-970-1

물성

구조 계산 물성보충 중

극성 표면적
3.2 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
2
무거운 원자 수
7
형식 전하
0
복잡도
28

실험 및 물리화학적 성질

Physical DescriptionBeige hygroscopic crystals; [Sigma-Aldrich MSDS]

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 5건

Danger

H301 (69.6%): Toxic if swallowed [Danger Acute toxicity, oral];H302 (31.6%): Harmful if swallowed [Warning Acute toxicity, oral];H311 (74.7%): Toxic in contact with skin [Danger Acute toxicity, dermal];H315 (69.6%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (69.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (67.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H341 (30.4%): Suspected of causing genetic defects [Warning Germ cell mutagenicity];H373 (24.1%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure];H411 (31.6%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P203, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 79 reports by companies from 22 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

Status: Active Update: 19-06-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/8275;Status: Active Update: 31-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/12032

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

Hazards Summary · 1건

A moderate skin and eye irritant; Causes somnolence, ataxia, and tremor in oral lethal-dose studies of rats; Causes diffuse hepatitis in 7-day intermittent oral studies of rats; [RTECS] A skin and strong eye irritant; Toxic by ingestion and skin absorption; [Sigma-Aldrich MSDS] See 1-Chloro-2-(diethylamine)ethane hydrochloride.

화학 및 산업

용도 및 제조

UsesUsed as an intermediate in chemical manufacture; [ExPub: ECHA REACH Registrations]
General Manufacturing InformationEthanamine, 2-chloro-N,N-dimethyl-, hydrochloride (1:1): ACTIVE

관련 반응

449건
반응 기록 만들기
HRID 26282 반응식
HRID 26282반응물로uspto-grants-1979_04
HRID 28396 반응식
HRID 28396반응물로uspto-grants-2008_09
HRID 28997 반응식
HRID 28997반응물로uspto-grants-2008_09
HRID 36729 반응식
HRID 36729반응물로uspto-grants-1995_05
HRID 40045 반응식
HRID 40045반응물로uspto-grants-2013_09
HRID 40303 반응식
HRID 40303반응물로uspto-grants-2013_09
HRID 41411 반응식
HRID 41411반응물로uspto-grants-2013_09
HRID 41476 반응식
HRID 41476반응물로uspto-grants-2013_09
1 / 57 페이지

화합물 노트

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Hazard Classes and CategoriesAcute Tox. 3 (69.6%);Acute Tox. 4 (31.6%);Acute Tox. 3 (74.7%);Skin Irrit. 2 (69.6%);Eye Irrit. 2 (69.6%);STOT SE 3 (67.1%);Muta. 2 (30.4%);STOT RE 2 (24.1%);Aquatic Chronic 2 (31.6%)

안전 및 보호

Protective Action Criteria (PAC) · 3건

0.71 [mg/m3]

7.9 [mg/m3]

47 [mg/m3]

독성 정보

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.

규제 정보

Regulatory Information · 2건

Status: Active Update: 19-06-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/8275;Status: Active Update: 31-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/12032

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