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에탄술포닐클로라이드

Ethanesulfonyl chloride

HCID 11667
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기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
594-44-5
표준 SMILES
CCS(=O)(=O)Cl
InChIKey
FRYHCSODNHYDPU-UHFFFAOYSA-N
분자식
C2H5ClO2S
평균 분자량
128.58 g/mol
단동위원소 질량
127.96987808

이름 및 식별자

우선 이름
Ethanesulfonyl chloride
IUPAC
ethanesulfonyl chloride
현지명
에탄술포닐클로라이드
영어명
Ethanesulfonyl chloride
분자식
C2H5ClO2S
분자량
128.58

이름 및 동의어

ETHANESULFONYL CHLORIDEEthylsulfonyl chlorideEthylsulfochloride1-Ethanesulfonyl chlorideEthanesulphonyl chlorideTL 77ethylsulfuryl chlorideEINECS 209-842-5NSC 8649UNII-B56ZOC898AEthane sulfochlorideBRN 0773865
이름 더 보기
에탄술포닐클로라이드에탄술포닐클로라이드에테인설폰일 클로라이드ethanesulflonyl chloridetl771,2-Ethane-disulfonicethylsulfurylchlorideTirofiban Impurity 72Ethyl sulfone chloride
B56ZOC898AHSDB 7487NSC-8649DTXSID0060486EC 209-842-54-04-00-00034 (Beilstein Handbook Reference)ETHANESULPHONYL CHLORIDE [HSDB]1-Ethanesulfonyl chloride(ChemID)

데이터베이스 식별자

CAS
594-44-5
PubChem CID
11667
DTXSID
DTXSID0060486
UNII
B56ZOC898A
EC Number
209-842-5
Nikkaji
J53.955D

물성

구조 계산 물성보충 중

XLogP
0.8
극성 표면적
42.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
6
형식 전하
0
복잡도
108

실험 및 물리화학적 성질

Chemical ClassesToxic Gases & Vapors -> Acid Halides
SpringerMaterials PropertiesBoiling point
Color/Form · 2건

Oil

Pale yellow

Solubility · 2건

Soluble in carbon disulfide

Slightly soluble (decomposes) in water and alcohol; very soluble in ether and dichloromethane.

Boiling Point177.5 °C
DecompositionWhen heated to decomposition it emits very toxic fumes of /hydrogen chloride and sulfur oxide/.
Vapor Pressure1.29 [mmHg]
Refractive IndexIndex of refraction: 1.4531 at 20 °C
Physical DescriptionPale yellow liquid; [HSDB] Colorless or yellow liquid; [MSDSonline]

물리화학적 성질

안전 및 규제

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

GHS 분류

GHS Classification · 4건

Danger

H302 (96.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P262, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P361+P364, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 58 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 06-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11864

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

Hazards Summary · 1건

A lachrymator; All rats exposed to 1273 ppm died within 30 to 130 minutes; 4-hr LC50 (rat) = approximately 86 ppm; Rats exposed to lethal concentrations have lacrimation, salivation, gasping, and pulmonary hemorrhage; [HSDB] Reacts violently with water; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis; Effects in high-dose animal studies include acute pulmonary edema; [MSDSonline]

Hazard Classes and CategoriesAcute Tox. 4 (96.6%)
Skin, Eye, and Respiratory Irritations/Ethanesulfonyl chloride is a/ lachrymator ...

안전 및 보호

Disposal Methods · 1건

SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal, aquatic, and plant life; and conformance with environmental and public health regulations.

화학 및 산업

용도 및 제조

Uses · 3건

Used to make sulfonyl-substituted imides, methide lithium salts, and pentafluoroethanesulfonyl fluoride, a fluorinated surfactant; [HSDB]

Intermediate in the syntheses of new, low-cost, non-fluorinated, sulfonyl-substituted imide and methide lithium salts.

Intermediate in the preparation of the fluorinated surfactant pentafluoroethanesulfonyl fluoride.

U.S. ProductionProduction volumes for non-confidential chemicals reported under the Inventory Update Rule. [Table#7143]
Methods of Manufacturing · 2건

Alkanesulfonyl chlorides are manufactured from mercaptans or disulfides and chlorine using a loop reactor having an ejector, wherein mercaptan or disulfide is dispersed or dissolved into circulating aqueous solvent before the ejector and alowed to react with chlorine supplied through the aspirator of the ejector.

Mercaptans or disulfide in aqueous solvents are reacted with chlorine gas in dark to produce alkanesulfonyl chloride without chloro chain byproducts. Thus, ... ethyl mercaptan was reacted with ... chlorine gas over 4 hours in /the/ dark in ... pure water keeping the reaction temperature under 20 °C to give ethanesulfonyl chloride.

General Manufacturing InformationEthanesulfonyl chloride: ACTIVE

상·하류 제품 정보

상류 원료

Sodium disulfideEthylthiocyanate

하류 제품

1-Ethylsulfonyl-piperazineMethyl ethanesulfonate에탄술폰아미드ABBV-075

관련 반응

704건
반응 기록 만들기
HRID 1069 반응식
HRID 1069반응물로uspto-grants-1998_03
HRID 5440 반응식
HRID 5440반응물로uspto-grants-1993_09
HRID 13717 반응식
HRID 13717반응물로uspto-grants-2010_06
HRID 18425 반응식
HRID 18425반응물로uspto-grants-2010_06
HRID 29304 반응식
HRID 29304반응물로uspto-grants-2008_09
HRID 30110 반응식
HRID 30110반응물로uspto-grants-2008_09
HRID 30121 반응식
HRID 30121반응물로uspto-grants-2008_09
HRID 30604 반응식
HRID 30604반응물로uspto-grants-2008_09
1 / 88 페이지

화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
더보기
새 노트새 반응견적 요청하기
녹는점
-70 °C · -70°C
끓는 점
171 °C · 171 °C
밀도
1.36 · 1.36
굴절률
1.45 · 1.45
인화점
88 °C · 88 °C
저장 조건
2 · Inert atmosphere,2-8°C
용해도
soluble in dichloromethane,Ether
물리적 상태
clear liquid
색상
Colorless to Almost colorless
수용성
물에서 분해되다
BRN
773865 · 773865
InChI
1S/C2H5ClO2S/c1-2-6(3,4)5/h2H2,1H3
InChIKey
FRYHCSODNHYDPU-UHFFFAOYSA-N
SMILES
CCS(Cl)(=O)=O
NIST
Ethanesulfonyl chloride(594-44-5)
EPA
Ethanesulfonyl chloride (594-44-5)

화학적 성질

clear light brownish to pinkish-purple liquid

Preventive Measures · 1건

SRP: Contaminated protective clothing should be segregated in such a manner so that there is no direct personal contact by personnel who handle, dispose, or clean the clothing. Quality assurance to ascertain the completeness of the cleaning procedures should be implemented before the decontaminated protective clothing is returned for reuse by the workers. Contaminated clothing should not be taken home at end of shift, but should remain at employee's place of work for cleaning.

독성 정보

Adverse EffectsDermatotoxin - Skin burns.
Human Toxicity Excerpts/SIGNS AND SYMPTOMS/ /Ethanesulfonyl chloride is a/ lachrymator ...
Non-Human Toxicity Excerpts · 3건

/LABORATORY ANIMALS: Acute Exposure/ A single dermal application of 2000 mg/kg to rabbits killed two of three animals. No deaths occurred following a dermal application of 200 mg/kg to rabbits.

/LABORATORY ANIMALS: Acute Exposure/ Acute (4-hr) inhalation studies indicated an LC50 of approximately 86 ppm in the rat. Clinical signs included eye irritation, lacrimation, salivation, and gasping. Decedents exhibited pulmonary hemorrhage. All rats died within 30 to 130 min during an exposure to 1273 ppm.

/LABORATORY ANIMALS: Acute Exposure/ Ethanesulfonyl chloride is corrosive to rabbit skin and eyes, and the vapor caused irritation of the eyes and respiratory tract. In rabbits, irritation of the eye 20 to 30 sec after instillation did not reduce the conjunctival necrosis, corneal opacity, or iridial changes. Corneal opacity persisted through 7 days.

Toxicity DataLCLo (rat) = 410 mg/m3/4h
Non-Human Toxicity Values · 2건

LD50 rat oral 360 mg/kg

LC50 rat inhalation 86 ppm/4 hr

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
KI8050000
ridadr
UN 2927 6.1/PG 2
HS 번호
2904990090
risk_code
21/22-23-34-22
hazard_code
T
safety_code
26-36/37/39-45
포장분류
II
위험 등급
6.1
F 고인화성물질
19-21
Hazard Classifications
Acute Tox. 2 InhalationAcute Tox. 4 DermalAcute Tox. 4 OralEye Dam. 1Skin Corr. 1BSTOT SE 3
스토리지 클래스
6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
유해 물질 데이터
594-44-5(Hazardous Substances Data)
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