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다이카프릴소듐설포석시네이트

Dioctyl Sodium Sulfosuccinate

HCID 517065
노트반응

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

기본 정보

CAS
1639-66-3
표준 SMILES
CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)[O-].[Na+]
InChIKey
RCIJACVHOIKRAP-UHFFFAOYSA-M
분자식
C20H37NaO7S
평균 분자량
444.6 g/mol
단동위원소 질량
444.21576897

이름 및 식별자

우선 이름
Dioctyl Sodium Sulfosuccinate
IUPAC
sodium 1,4-dioctoxy-1,4-dioxobutane-2-sulfonate
현지명
다이카프릴소듐설포석시네이트
영어명
Sulfonated aliphatic polyester
분자식
C20H39NaO7S
분자량
446.57

이름 및 동의어

Sodium dioctyl sulfosuccinateSodium di-n-octyl sulfosuccinateDioctyl sodiosulfosuccinateSodium bis(octyl)sulfosuccinateDTXSID7041881Sodium O,O-dioctylsulfosuccinic acidSodium sulfosuccinic acid dioctyl esterSulfosuccinic acid 1,4-dioctyl ester sodium saltDioctyl sulfosuccinate, sodium saltRefChem:1083745DTXCID5021881Dioctyl Sodium Sulfosuccinate
이름 더 보기
다이카프릴소듐설포석시네이트Sodium diethylhexyl sulfosuccinateSodium 1,4-bis(octyloxy)-1,4-dioxobutane-2-sulfonateelfanol883Penetrant Tmonawetmo-70Penetrant OTmonawetmo-70rpJACS-1639-66-3
Dioctyl sodium sulphosuccinate1639-66-3Texapon DOSButyl-cerumenBu-cerumenNeocol SW 30DI-N-OCTYL SODIUM SULFOSUCCINATESolbaleite

데이터베이스 식별자

CAS
1639-66-3、577-11-7
PubChem CID
517065
DTXSID
DTXSID7041881
UNII
4YLY5570Y0
EC Number
216-684-0
Nikkaji
J877J

물성

구조 계산 물성보충 중

극성 표면적
118 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
20
무거운 원자 수
29
형식 전하
0
복잡도
517

실험 및 물리화학적 성질

Density · 2건

1.1 at 68 °F (solid or liquid) (USCG, 1999) - Denser than water; will sink

1.1 @ 20°C

Melting Point · 2건

311 °F (USCG, 1999)

155 °C

Physical DescriptionDioctyl sodium sulfosuccinate is an odorless colorless to white waxy solid. Sinks and mixes slowly with water. (USCG, 1999)

물리화학적 성질

저장 조건
Store at room temperature, keep dry and cool
InChI
InChI=1S/C20H38O7S.Na.H/c1-3-5-7-9-11-13-15-26-19(21)17-18(28(23,24)25)20(22)27-16-14-12-10-8-6-4-2;;/h18H,3-17H2,1-2H3,(H,23,24,25);;
InChIKey
MDXHMBGGFODZQG-UHFFFAOYSA-N
SMILES
C(S(O)(=O)=O)(C(=O)OCCCCCCCC)CC(=O)OCCCCCCCC.[NaH]
EPA
Di-n-octyl sodium sulfosuccinate (1639-66-3)

안전 및 규제

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

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 2.6% (1 of 39) of reports.

Warning

H302 (97.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, 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.;Reported as not meeting GHS hazard criteria per 1 of 39 reports by companies.;There is 1 notification provided by 38 of 39 reports by companies with hazard statement code(s).;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 · 3건

Chemical: Butanedioic acid, sulfo-, 1,4-dioctyl ester, sodium salt

2002/2076

Di-n-octyl sodium sulfosuccinate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Fire HazardsBehavior in Fire: Causes foaming and spreading of water. Assists in putting out fires by water. (USCG, 1999)
Health HazardsLiquid is strong irritant to eye and may irritate skin by removing natural oils. Ingestion causes diarrhea and intestinal bloating. (USCG, 1999)
Reactive GroupEsters, Sulfate Esters, Phosphate Esters, Thiophosphate Esters, and Borate Esters;Sulfonates, Phosphonates, and Thiophosphonates, Organic;Salts, Basic
Reactivity ProfileDIOCTYL SODIUM SULFOSUCCINATE causes foaming and spreading of water. Assists in putting out fires by water. (USCG, 1999).

화학 및 산업

약리 정보

Mechanism of ActionThe laxative action is said to result from enhanced penetration of water into the fecal mass in the presence of the wetting agent. ... Action on the intestinal mucosa may contribute to or account for the laxative effect.
Absorption, Distribution and Excretion... Docusate sodium is absorbed, appears in the bile in significant concn ... .

용도 및 제조

Uses · 2건

CIR ingredient: Dicapryl Sodium Sulfosuccinate

MEDICATION

Household ProductsInformation on 3 consumer products that contain Sodium di-n-octyl sulfosuccinate in the following categories is provided:;• Inside the Home;• Personal Care
Use ClassificationFood Additives -> EMULSIFIER; HUMECTANT -> JECFA Functional Classes
응용 분야 · 1건

용도Dioctylsulfosuccinic Acid Sodium Salt is a surfactant which can be used in the preparation of microemulsions of ionic liquid-CdS quantum dots hybrid materials as potential white light harvesting systems. It can also be useful in the study of micelle aggregation. It is a related compound of Docusate (CAS # 10041-19-7), which is used in the treatment of constipation.

상·하류 제품 정보

상류 원료

2-에틸-1-핵산올P-톨루엔설폰 산말레산 무수물

관련 반응

0건
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화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
Air and Water ReactionsMixes slowly with water.
Hazard Classes and CategoriesAcute Tox. 4 (97.4%)
Skin, Eye, and Respiratory IrritationsLiquid is strong irritant to eye and may irritate skin by removing natural oils.

안전 및 보호

First AidEYES: irrigate with copious volumes of water for at least 15 min.; call physician.;SKIN: rinse off with water.;INGESTION: drink large amounts of water. (USCG, 1999)
Disposal Methods · 1건

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Preventive Measures · 1건

SRP: The scientific literature for the use of contact lenses in industry is conflicting. The benefit or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.

Protective Action Criteria (PAC) · 3건

20 [mg/m3]

63 [mg/m3]

380 [mg/m3]

Personal Protective Equipment (PPE) · 2건

Chemical goggles; rubber gloves; dust respirator. (USCG, 1999)

Chemical goggles; rubber gloves; dust respirator.

독성 정보

InteractionsDocusates increase the intestinal absorption of other drugs administered concurrently and may increase their toxicity. /Docusates/
Toxicity Summary · 2건

The CIR Expert Panel concluded that the following 8 dialkyl sulfosuccinate salts are safe in the present practices of use and concentration in cosmetics in this safety assessment when formulated to be non-irritating...Dicapryl Sodium Sulfosuccinate...

Safe for use in cosmetics, with qualifications

Human Toxicity Excerpts · 3건

Ingestion causes diarrhea and intestinal bloating.

The docusates are well tolerated. Cramping pains have been reported occasionally, and the liquid preparations sometimes cause nausea. /Docusates/

Of particular concern are the observations that docusate sodium is absorbed, appears in the bile in significant conc, and has cytotoxic effects on liver cells in tissue culture.

Non-Human Toxicity Excerpts · 3건

Water and salt accumulated in ligated colonic segments of DSS-treated rats whereas net absorption of isotonic saline solution occurred in control rats. When segments of rodent ileum, jejunum and colon were perfused with 0.5 mM DSS, mucosal cells were flattened and their brush borders disappeared. ... Only diarrhea and intestinal bloating are reported in animals given toxic doses.

In chronic feeding tests, fatally poisoned rats showed no gross lesions outside of the GI.

Eye irritation may be caused by solutions containing more than 0.1% DSS.

Non-Human Toxicity ValuesLD50 Rat oral 1.9 g/kg

규제 정보

Regulatory Information · 3건

Chemical: Butanedioic acid, sulfo-, 1,4-dioctyl ester, sodium salt

2002/2076

Di-n-octyl sodium sulfosuccinate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

안전 데이터

tsca
TSCA listed
기존화학 물질
KE-31434
유해 물질 데이터
1639-66-3(Hazardous Substances Data)
AlcoholMixture
Para toluene
Esterified product
산성아황산나트륨

하류 제품

penetrating agent TXscouring agent TS-DHC디옥틸설포석시네이트

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