리액티브레드239

1,5-naphthalenedisulfonic acid, 2-((8-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, pentasodium salt

HCID 136171109
노트반응
부분 구조 검색유사 구조 찾기

기본 정보

CAS
673485-67-1
표준 SMILES
O=S(=O)([O-])OCCS(=O)(=O)c1ccc(Nc2nc(Cl)nc(Nc3cc(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])c(N=Nc5ccc6c(S(=O)(=O)[O-])cccc6c5S(=O)(=O)[O-])c(O)c34)n2)cc1.[Na+].[Na+].[Na+].[Na+].[Na+]
InChIKey
YYOYUTRZHZNCFZ-UHFFFAOYSA-I
분자식
C31H19ClN7Na5O19S6
평균 분자량
1,136.3 g/mol
단동위원소 질량
1,134.8236975

이름 및 식별자

우선 이름
1,5-naphthalenedisulfonic acid, 2-((8-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, pentasodium salt
IUPAC
pentasodium;5-[[4-chloro-6-[4-(2-sulfonatooxyethylsulfonyl)anilino]-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonatonaphthalen-2-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonate
현지명
리액티브레드239
영어명
Reactive Red 239
분자식
C31H25ClN7NaO19S6
분자량
1050.37

이름 및 동의어

1,5-Naphthalenedisulfonic acid, 2-[2-[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:5)1,5-Naphthalenedisulfonic acid, 2-((8-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, pentasodium salt1,5-Naphthalenedisulfonic acid, 2-(2-(8-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:5)673485-67-11,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, pentasodium saltRefChem:4173431,5-Naphthalenedisulfonic acid, 2-8-4-chloro-6-4-2-(sulfooxy)ethylsulfonylphenylamino-1,3,5-triazin-2-ylamino-1-hydroxy-3,6-disulfo-2-naphthalenylazo-, pentasodium salt618-246-8842-549-689157-03-9pentasodium;5-[[4-chloro-6-[4-(2-sulfonatooxyethylsulfonyl)anilino]-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonatonaphthalen-2-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonateC.I. Reactive Red 241
이름 더 보기
리액티브레드239Red 3BSReactive Red 241Reactive Red 239Brilliant Red 2BFReactive red 241 (C.I. 18220)C.I.Reactive Red 241:C.I.18220pentasodium,(3Z)-5-[[4-chloro-6-[4-(2-sulfonatooxyethylsulfonyl)anilino]-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonatonaphthalen-2-yl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate1,5-Naphthalenedisulfonic acid, 2-[2-[8-[[4-chloro-6-[[4-[[2-( sulfooxy)ethyl]sulfonyl]phenyl]amino]-1 ,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-d isulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:5)
DTXSID00890423NS000785331,5-Naphthalenedisulfonicacid,2-[2-[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]diazenyl]-,sodium salt (1:5)Pentasodium 2-({8-[(4-chloro-6-{4-[2-(sulfonatooxy)ethanesulfonyl]anilino}-1,3,5-triazin-2-yl)amino]-1-hydroxy-3,6-disulfonatonaphthalen-2-yl}diazenyl)naphthalene-1,5-disulfonate

데이터베이스 식별자

CAS
673485-67-1、89157-03-9
PubChem CID
136171109
DTXSID
DTXSID00890423
EC Number
618-246-8、842-549-6

물성

구조 계산 물성

극성 표면적
487 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
26
회전 가능 결합 수
10
무거운 원자 수
69

실험 및 물리화학적 성질

Physical DescriptionCBI

물리화학적 성질

밀도
1.57 · 1.57[at 20℃]
증기압
0 Pa · 0Pa at 25℃
용해도
0.05 in · 0.05 in mg/100g standard fat at 20 ℃
산도 계수 (pKa)
-3.02 · -3.02[at 20 ℃]
수용성
299 g/L · 299g/L at 20℃
LogP
-2 at · -2 at 20℃

안전 및 규제

GHS 분류

GHS Classification · 2건

Not Classified

Not Classified

유해성 정보

Regulatory Information · 4건

Chemical: 1,5-Naphthalenedisulfonic acid, 2-[2-[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:5)

1,5-Naphthalenedisulfonic acid, 2-[2-[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:5) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,5-Naphthalenedisulfonic acid, 2-[2-[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:5) 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

1,5-Naphthalenedisulfonic acid, 2-8-4-chloro-6-4-2-(sulfooxy)ethylsulfonylphenylamino-1,3,5-triazin-2-ylamino-1-hydroxy-3,6-disulfo-2-naphthalenylazo-, pentasodium salt: 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.

Other Safety InformationIMAP assessments - 1,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, pentasodium salt: Human health tier I assessment
Hazard Classes and Categories · 2건

Not Classified

Not Classified

안전 데이터

tsca
TSCA listed

화학 및 산업

용도 및 제조

U.S. Production2023: <75,000 lb
Consumer UsesDye
Industry UsesDye
General Manufacturing Information · 2건

Textiles, apparel, and leather manufacturing

1,5-Naphthalenedisulfonic acid, 2-[2-[8-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:5): ACTIVE

제조 방법

2-Aminonaphthalene-1,5-disulfonic acid diazo, and 4-Amino-5-hydroxynaphthalene-2,7-disulfonic acidcoupling, and 2,4,6-Trichloro-1,3,5-triazine and 2-Aminobenzenesulfonic acid condensation.

상·하류 제품 정보

공급사4 곳

Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
Xiamen Eagle Chemical Limited Corporation+86-18900207489 · [email protected]
LUYUNJIA CHEMISTRY XIAMEN LIMITED+86-592-5360779 +86-13055435203
Mainchem Co., Ltd.+86-86-05926210733 · [email protected]

관련 반응

0건
반응 기록 만들기

현재 필터 조건에 해당하는 반응 기록이 없습니다.

화합물 노트

불러오는 중…