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Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide

HCID 3034140
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
3637-26-1
표준 SMILES
C=C(C)C(=O)OCC[N+](C)(C)CCCS(=O)(=O)[O-]
InChIKey
BCAIDFOKQCVACE-UHFFFAOYSA-N
분자식
C11H21NO5S
평균 분자량
279.36 g/mol
단동위원소 질량
279.11404394

이름 및 식별자

우선 이름
Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide
IUPAC
3-[dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azaniumyl]propane-1-sulfonate
영어명
[2-(Methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)ammonium hydroxide
분자식
C11H21NO5S
분자량
279.35

이름 및 동의어

3637-26-1Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxideEINECS 222-860-8DTXSID10189895Dimethyl[2-[(2-methyl-1-oxoallyl)oxy]ethyl](3-sulphopropyl)ammonium hydroxideRefChem:134284DTXCID70112386222-860-83-[dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azaniumyl]propane-1-sulfonate3-((2-(Methacryloyloxy)ethyl)dimethylammonio)propane-1-sulfonate[2-(Methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)ammonium hydroxideDMAPS
이름 더 보기
SPEDAPSMethacryloxyethyl sulfobetaine3-dimethyl(methacryloyloxyethyl) ammonium propane sulfonateN-(3-SULFOPROPYL)-N-METHACROYLOXYETHYL-N,N-DIMETHYL-AMMONIUM BETAINE
MFCD00040574SCHEMBL866754N-(3-Sulfopropyl)-N-methacryloxyethyl-N,N-dimethylammonium betaine1-Propanaminium,N,N-dimethyl-N-[2-[(2-methyl-1-oxo-2-propenyl)oxy]ethyl]-3-sulfo-, innersalt2-(N-3-Sulfopropyl-N,N-dimethyl ammonium)ethyl methacrylate[2-(Methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)3-[[2-(Methacryloyloxy)ethyl]dimethylammonio]propane-1-sulfonate3-[N-(2-methacryloxylethyl)-N,N-dimethylammonio]-propane sulfonate

물성

구조 계산 물성

XLogP
0.3
극성 표면적
91.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
8
무거운 원자 수
18
형식 전하
0
복잡도
381

물리화학적 성질

녹는점
150 · 150-155 °C(lit.)
밀도
1.293 · 1.293-1.303g/cm3 at 22℃
인화점
110 °C · >110°C
저장 조건
30 °C · Store below +30°C.
용해도
500 g/L · 500g/L
물리적 상태
가루
색상
흰색에서 거의 흰색
수소이온지수(pH)
6.3 · 6.3 (100g/l, H2O, 20℃)
수용성
500 g/L · 500g/L
InChI
InChI=1S/C11H21NO5S/c1-10(2)11(13)17-8-7-12(3,4)6-5-9-18(14,15)16/h1,5-9H2,2-4H3
InChIKey
BCAIDFOKQCVACE-UHFFFAOYSA-N
SMILES
[N+](C)(C)(CCOC(=O)C(=C)C)CCCS([O-])(=O)=O
LogP
-4.23 · -4.23

안전 및 규제

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

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 14.6% (7 of 48) of reports.

Warning

H302 (85.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P280, P301+P317, P302+P352, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationREACH registered substance: Dimethyl[2-[(2-methyl-1-oxoallyl)oxy]ethyl](3-sulphopropyl)ammonium hydroxide (EC: 222-860-8)
Hazard Classes and CategoriesAcute Tox. 4 (85.4%)

안전 데이터

wgk
3
HS 번호
29239000
risk_code
21/22
hazard_code
Xn
safety_code
37/39
스토리지 클래스
11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

용도Due to its hygroscopic nature, [2-(methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)ammonium hydroxide (DMAPS) can contain up to one molecule of water per monomer unit. This material should be stored in a cool, dry place and depending on the reaction conditions, water may need to be removed prior to polymerization.

일반 설명[2-(Methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)ammonium hydroxide (DMAPS) is a hygroscopic, zwitterionic monomer used in the synthesis of polysulfobetaines. Polysulfobetaines are electrically neutral polymers that contain both cationic and anionic groups within a single monomer unit and feature interesting properties such as antielectrolyte behavior in aqueous salt solutions, biocompatibility, and hemocompatibility. Based upon these properties, polysulfobetaines are useful in many biomedical applications such as drug delivery and drug formulation.

공급사100 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
维吉特新材料科技(泰州)有限公司13799389356 19515869697 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]

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데이터베이스 식별자

CAS
3637-26-1
PubChem CID
3034140
DTXSID
DTXSID10189895
UNII
H3J8G77YWZ
EC Number
222-860-8
Nikkaji
J205.558I
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