광택이나는 BLUE R-250
Coomassie Brilliant Blue R
기본 정보
- CAS
6104-59-2- 표준 SMILES
CCOc1ccc(Nc2ccc(C(=C3C=CC(=[N+](CC)Cc4cccc(S(=O)(=O)[O-])c4)C=C3)c3ccc(N(CC)Cc4cccc(S(=O)(=O)[O-])c4)cc3)cc2)cc1.[Na+]- InChIKey
NKLPQNGYXWVELD-UHFFFAOYSA-M- 분자식
- C45H44N3NaO7S2
- 평균 분자량
- 826 g/mol
- 단동위원소 질량
- 825.25183703
이름 및 식별자
- 우선 이름
- Coomassie Brilliant Blue R
- IUPAC
- sodium 3-[[4-[[4-(4-ethoxyanilino)phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate
- 현지명
- 광택이나는 BLUE R-250
- 영어명
- Acid Blue 83
- 분자식
- C45H46N3NaO7S2
- 분자량
- 827.99
이름 및 동의어
6104-59-2Brilliant Blue RCOOMASSIE BRILLIANT BLUE RC.I. Acid Blue 83TKL1K0PT9AEriosin Brilliant Cyanine 6BCoomassie blue R 250EINECS 228-060-5DTXSID80910613COOMASSIE BRILLIANT BLUE R [MI]Benzenemethanaminium, N-(4-((4-((4-ethoxyphenyl)amino)phenyl)(4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-3-sulfo-, inner salt, sodium salt (1:1)Benzenemethanaminium, N-(4-((4-((4-ethoxyphenyl)amino)phenyl)(4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-3-sulfo-, hydroxide, inner salt, monosodium salt
이름 더 보기
광택이나는BLUER-250광택이나는BLUER-250R-250BRILLIANT BLUE R250COOMASSIE BRILLIANT BLUECOOMASSIE BRILLIANT BLUE R-250CI 42660CBB R-250CI NO 42660Brilliant RSERVA BLUE R
Benzenemethanaminium, N-(4-((4-((4-ethoxyphenyl)amino)phenyl)(4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-3-sulfo-, inner salt, monosodium saltBenzenemethanaminium, N-[4-[[4-[(4-ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-, hydroxide, inner salt, monosodium saltBenzenemethanaminium, N-[4-[[4-[(4-ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-, inner salt, monosodium saltHydrogen (4-(4-(p-ethoxyanilino)-4'-(ethyl(m-sulphonatobenzyl)amino)benzhydrylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(m-sulphonatobenzyl)ammonium, monosodium saltHydrogen [4-[4-(p-ethoxyanilino)-4'-[ethyl(m-sulphonatobenzyl)amino]benzhydrylene]cyclohexa-2,5-dien-1-ylidene](ethyl)(m-sulphonatobenzyl)ammonium, monosodium saltBenzenemethanaminium, N-[4-[[4-[(4-ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-, inner salt, sodium salt (1:1)RefChem:578669DTXCID801339658
데이터베이스 식별자
- CAS
6104-59-2- PubChem CID
- 61365
- DTXSID
DTXSID80910613- ChEMBL
CHEMBL4279842- UNII
- TKL1K0PT9A
- EC Number
- 228-060-5
물성
구조 계산 물성
- 극성 표면적
- 159 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 58
- 형식 전하
- 0
- 복잡도
- 1,500
실험 및 물리화학적 성질
Chemical ClassesDyes -> Di- and Triaryl Dyes
Physical DescriptionBlue crystals; [MSDSonline]
물리화학적 성질
- 녹는점
- 174 · 174-180 °C
- 증기 밀도
- 28.5 · 28.5 (vs air)
- 인화점
- 14 °C · 14 °C
- 저장 조건
- room temp
- 용해도
- 2 O: · H2O: 용해성10mg/mL
- 물리적 상태
- 분말/고체
- 색상
- 적갈색
- 수소이온지수(pH)
- 6.2 · 6.2 (25°C, 10g/L in H2O)
- 수용성
- 물에 용해됩니다.
- BRN
- 5718025 · 5718025
- 안정성
- 감광성
- 주요 응용
- 진단 검사 제조혈액학조직학
- InChIKey
- NKLPQNGYXWVELD-UHFFFAOYSA-M
- SMILES
- [Na+].CCOc1ccc(Nc2ccc(cc2)C(\c3ccc(cc3)N(CC)Cc4cccc(c4)S([O-])(=O)=O)=C5\C=C/C(C=C5)=[N+](\CC)Cc6cccc(c6)S([O-])(=O)=O)cc1
- EPA
- 83 · C.I. Acid Blue 83 (6104-59-2)
화학적 성질
dark bordeaux to dark purplish-brown cryst. powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 53.8% (28 of 52) of all reports.
Warning
H302 (15.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 52 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzenemethanaminium, N-[4-[[4-[(4-ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-, hydroxide, inner salt, monosodium salt
Coomassie Brilliant Blue R: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryA skin, eye, and respiratory tract irritant; [MSDSonline]
Hazard Classes and CategoriesEye Irrit. 2 (23.1%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- HS 번호
- 32041200
- 기존화학 물질
- KE-06366
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
UsesLaboratory reagent; [MSDSonline]
General Manufacturing InformationBenzenemethanaminium, N-[4-[[4-[(4-ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-, inner salt, sodium salt (1:1): ACTIVE
응용 분야
용도Acid Blue 83 is a dye commonly used in laboratories or quantify proteins.
제조 방법
p-Chlorobenzaldehyde(1 Moore) and 3-(Ethyl(phenyl)amino)methyl)benzenesulfonic acid (2 Moore) condensation, and heavy chromate salt-oxalic acid oxidation its product, again with 4-Ethoxybenzenamine condensation.
상·하류 제품 정보
상류 원료
관련 반응
2건
화합물 노트
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