Reactive Blue 4

HCID 25863CAS 13324-20-4
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Nc1c(S(=O)(=O)O)cc(Nc2ccc(S(=O)(=O)O)c(Nc3nc(Cl)nc(Cl)n3)c2)c2c1C(=O)c1ccccc1C2=O
InChIKey
RTLULCVBFCRQKI-UHFFFAOYSA-N
분자식
C23H14Cl2N6O8S2
평균 분자량
637.4 g/mol
단동위원소 질량
635.96915877

개요

used in affinity labeling of enzymes; RN given refers to parent cpd

이름 및 식별자

우선 이름
Reactive Blue 4
IUPAC
1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfoanilino]-9,10-dioxoanthracene-2-sulfonic acid
영어명
REACTIVE BLUE 4
분자식
C23H14Cl2N6O8S2
분자량
637.43

이름 및 동의어

Reactive Blue 4Procion blue MX-R13324-20-4C.I. Reactive Blue 4Ostazin Brilliant Blue S-RNSC-364368M3J92M47JZDTXSID20654122-Anthracenesulfonic acid, 1-amino-4-((3-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-2-Anthracenesulfonic acid, 1-amino-4-[[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-RefChem:868544DTXCID0034140
이름 더 보기
CI 61205Blue MRCI NO 61205modrreaktivni4Ambifix Blue CRBrill.Blue X-BROstazin Blue S-RViactive Blue MRReactive Blue MR
236-363-9MFCD00001218NSC3643681-amino-4-((3-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfoanilino]-9,10-dioxoanthracene-2-sulfonic acid1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfo-anilino]-9,10-dioxo-anthracene-2-sulfonic acidProcion Brilliant Blue MRMikacion Brilliant Blue RS

데이터베이스 식별자

CAS
13324-20-4
PubChem CID
25863
DTXSID
DTXSID2065412
ChEMBL
CHEMBL1741102
UNII
M3J92M47JZ
EC Number
236-363-9
Nikkaji
J9.564H

물성

구조 계산 물성

XLogP
4.7
극성 표면적
248 Ų
수소 결합 공여자 수
5
수소 결합 수용자 수
14
회전 가능 결합 수
6
무거운 원자 수
41

물리화학적 성질

끓는 점
291 °C · 291°C (rough estimate)
밀도
1.5315 · 1.5315 (rough estimate)
굴절률
1.6 · 1.6000 (estimate)
저장 조건
2 · 2-8°C
물리적 상태
식염수 현탁액
산도 계수 (pKa)
-1.22 · -1.22±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 3 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 2건

Chemical: 2-Anthracenesulfonic acid, 1-amino-4-[[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-

2-Anthracenesulfonic acid, 1-amino-4-3-(4,6-dichloro-1,3,5-triazin-2-yl)amino-4-sulfophenylamino-9,10-dihydro-9,10-dioxo-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesEye Irrit. 2 (100%)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
CB1030000
독성
rat,LD50,oral,8980mg/kg (8980mg/kg),"Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 1328, 1986.
risk_code
36
hazard_code
Xi

화학 및 산업

용도 및 제조

General Manufacturing Information2-Anthracenesulfonic acid, 1-amino-4-[[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-: ACTIVE

응용 분야

용도Reactive Blue 4 (CAS# 13324-20-4) is an organic dye used in textiles. Reactive Blue 4 is water-soluble and a pollutant, and has been decolourized in water using microbial fuel cells. Dyes and metabolites.

제조 방법

1-Amino-4-bromo-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid and 2,4-Diaminobenzenesulfonic acid condensation, and 2,4,6-Trichloro-1,3,5-triazine condensation and salting-out.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

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