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옥틸 황산 나트륨

Sodium Octyl Sulfate

HCID 2735107
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기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
142-31-4
표준 SMILES
CCCCCCCCOS(=O)(=O)[O-].[Na+]
InChIKey
WFRKJMRGXGWHBM-UHFFFAOYSA-M
분자식
C8H17NaO4S
평균 분자량
232.28 g/mol
단동위원소 질량
232.0745243

이름 및 식별자

우선 이름
Sodium Octyl Sulfate
IUPAC
sodium octyl sulfate
현지명
옥틸 황산 나트륨
영어명
Sodium octyl sulfate
분자식
C8H19NaO4S
분자량
233.28

이름 및 동의어

Sodium octyl sulfate142-31-4Sodium octyl sulphateCycloryl OSDuponol 80Sipex olsOCTYL SODIUM SULFATESodium capryl sulfateSulfuric acid, monooctyl ester, sodium saltDTXSID90362266RZL727210Sulfuric acid, monooctyl ester, sodium salt (1:1)
이름 더 보기
옥틸황산나트륨옥틸황산나트륨sosS8sipexolsduponol80cyclorylosNatriumoctylsulfatsodiumcaprylsulfatesodiumoctylsulphateSODIUMISOCTYLSULFATE
DTXCID7016226RefChem:184025205-535-5sodium n-octyl sulfatesodium;octyl sulfateCdc25 inhibitorMFCD0000747036609-96-8

데이터베이스 식별자

CAS
142-31-4
PubChem CID
2735107
DTXSID
DTXSID9036226
ChEMBL
CHEMBL556674
UNII
6RZL727210
EC Number
205-535-5
Nikkaji
J66.348D

물성

구조 계산 물성

극성 표면적
74.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
8
무거운 원자 수
14
형식 전하
0
복잡도
198

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Sulfonates, Alkane and Alkene
Physical Description · 2건

Liquid; CBI

White powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
195 °C · 195 °C (dec.) (lit.)
밀도
1.04 · 1.04
증기 밀도
8 · 8 (vs air)
증기압
0.31 Pa · 0.31Pa at 20℃
인화점
93.3 °C · 93.3°C
저장 조건
no restrictions.
용해도
2 O: · H2O: 가용성20mg/mL
물리적 상태
큰 입자 분말
색상
하얀색
수소이온지수(pH)
6 · 6-8 (10g/l, H2O, 20℃)
냄새
특유의 냄새
수용성
녹는
BRN
3658635 · 3658635
안정성
안정적인. 산화제와 호환되지 않습니다.
화장품 원료 기능
계면활성제 - 하이드로트로프계면활성제 - 세정점도 조절
InChI
1S/C8H18O4S.Na/c1-2-3-4-5-6-7-8-12-13(9,10)11;/h2-8H2,1H3,(H,9,10,11);/q;+1/p-1

안전 및 규제

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

GHS 분류

GHS Classification · 6건

Danger

H228 (17.7%): Flammable solid [Danger Flammable solids]

P210, P240, P241, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 628 reports by companies from 17 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

유해성 정보

Regulatory Information · 4건

Chemical: Sulfuric acid, monooctyl ester, sodium salt

Sulfuric acid, monooctyl ester, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Sulfuric acid, monooctyl ester, sodium salt (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 05-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/12701

Sulfuric acid, monooctyl ester, sodium salt: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1건

Causes somnolence, gastritis, and diarrhea in oral lethal-dose studies of rats; [RTECS] Commercial fatty alkyl sulfates are usually available as 30% pastes (higher concentrations difficult to handle); Highly concentrated alkyl sulfates are severely irritating or corrosive; Concentrations above 10% can cause permanent eye injury; No evidence of skin sensitization in human patch test studies; [OECD SIDS] A skin and strong eye irritant; [Alfa Aesar MSDS] See Sulfuric acid, mono-C10-16-alkyl esters, sodium salts.

EPA Safer ChemicalChemical: Sodium octyl sulfate

화학 및 산업

용도 및 제조

Uses · 2건

Alkyl sulfates are primarily used as wool-washing agents and as active ingredients in laundry detergents; Also used in various personal care products (i.e. toothpastes, shampoos, and cosmetics), in some foods, for froth flotation in pharmaceuticals, pigment dispersion, in a range of cleaning products, fire fighting foams, emulsifiers for insecticides, and for making printing inks; [OECD SIDS] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]

Textiles (Fiber & Fabric Manufacturing) [Category: Industry]

U.S. Production2023: 1,000,000 - <2,500,000 lb
Consumer UsesEmulsifier
Industry UsesProcessing aids not otherwise specified
Household ProductsInformation on 25 consumer products that contain Sodium octyl sulfate in the following categories is provided:
Use Classification · 2건

EPA Safer Chemical Functional Use Classes -> Surfactants

Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern

General Manufacturing Information · 2건

Agriculture, Forestry, Fishing and Hunting

Sulfuric acid, monooctyl ester, sodium salt (1:1): ACTIVE

응용 분야 · 2건

용도Sodium octyl sulfate has been used in a study to assess selective enrichment of albumin in biological samples. It has also been used in a study to investigate the behavior of mixed solution of a glycerin-modified cationic surfactant and an anionic surfactant.

일반 설명Sodium octyl sulfate is an anionic detergent and ion pairing reagent that is used in HPLC

관련 반응

4건
반응 기록 만들기
HRID 45916 반응식
HRID 45916반응물로uspto-grants-2013_09
HRID 851831 반응식
HRID 851831반응물로uspto-grants-2007_08
HRID 1005623 반응식
HRID 1005623반응물로uspto-grants-2004_09
HRID 1984957 반응식
HRID 1984957반응물로uspto-grants-2009_06

화합물 노트

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이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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InChIKey
WFRKJMRGXGWHBM-UHFFFAOYSA-M
SMILES
[Na+].CCCCCCCCOS([O-])(=O)=O
LogP
3.269 · 3.269 (est)
EPA
Sodium octyl sulfate (142-31-4)

화학적 성질

white solid

Hazard Classes and Categories · 2건

Flam. Sol. 1 (17.7%)

Skin corrosion/irritation - Category 1

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
WT1175000
독성
LD50 orally in Rabbit: 3200 mg/kg
HS 번호
29209010
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36-37/39
기존화학 물질
KE-31560
스토리지 클래스
11 - Combustible Solids

추가 설명

정의Anionic deter- gent, available commercially as a 35% solution.