기본 정보
- 표준 SMILES
CC1(C)Nc2cccc3c(N=Nc4ccc(N=Nc5ccccc5)c5ccccc45)ccc(c23)N1- InChIKey
YCUVUDODLRLVIC-UHFFFAOYSA-N- 분자식
- C29H24N6
- 평균 분자량
- 456.5 g/mol
- 단동위원소 질량
- 456.20624477
개요
Sudan black B is a member of the class of perimidines that is 2,2-dimethyl-2,3-dihydro-1H-perimidine carrying a [4-(phenyldiazenyl)naphthalen-1-yl]diazenyl substituent at position 6. A fat-soluble dye predominantly used for demonstrating triglycerides in frozen sections and for staining of protein bound lipids in paraffin sections. It has a role as a histological dye. It is a member of azobenzenes, a member of perimidines and a bis(azo) compound.
이름 및 식별자
- 우선 이름
- Sudan Black B
- IUPAC
- (2,2-dimethyl-1,3-dihydroperimidin-6-yl)-(4-phenyldiazenylnaphthalen-1-yl)diazene
- 현지명
- 수단 블랙 B
- 영어명
- Solvent Black 3
- 분자식
- C29H24N6
- 분자량
- 456.54
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
4197-25-5- PubChem CID
- 61336
- DTXSID
DTXSID0052091- ChEMBL
CHEMBL1872445- ChEBI
CHEBI:88216- UNII
- 9YDL1Q990E
- EC Number
- 224-087-1
- Nikkaji
- J34.104E
물성
구조 계산 물성
- XLogP
- 8.4
- 극성 표면적
- 73.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 773
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 120 · 120-124 °C(lit.)
- 끓는 점
- 552.68 °C · 552.68°C (rough estimate)
- 밀도
- 1.4899 · 1.4899 (rough estimate)
- 굴절률
- 1.457 · 1.4570 (estimate)
- 저장 조건
- Store at RT.
- 용해도
- 물에 불용성; 에탄올, 아세톤, 벤젠, 톨루엔, 자일렌, 에틸렌 글리콜에 용해됩니다.
- 산도 계수 (pKa)
- 2.94 · 2.94±0.40(Predicted)
- 물리적 상태
- 분말/고체
- 색상
- 매우 어두운 갈색에서 검정색까지
- 수용성
- 오일, 지방, 따뜻한 바셀린, 파라핀, 페놀, 에탄올, 아세톤, 벤젠, 톨루엔 및 탄화수소에 용해됩니다. 물에 불용성.
- Merck
- 13 · 13,8970
- BRN
- 723248 · 723248
- 안정성
- 감광성
- 주요 응용
- 진단 검사 제조혈액학조직학
- 화장품 원료 기능
- 머리 염색
- InChI
- 1S/C29H24N6/c1-29(2)30-26-14-8-13-22-25(17-18-27(31-29)28(22)26)35-34-24-16-15-23(20-11-6-7-12-21(20)24)33-32-19-9-4-3-5-10-19/h3-18,30-31H,1-2H3/b33-32+,35-34+
- InChIKey
- YCUVUDODLRLVIC-VPHDGDOJSA-N
- SMILES
- CC1(C)Nc2cccc3c(ccc(N1)c23)\N=N\c4ccc(\N=N\c5ccccc5)c6ccccc46
- EPA
- 3 · C.I. Solvent Black 3 (4197-25-5)
화학적 성질
It is a very dark brown to black fine crystalline powder. It is soluble in ethanol, toluene, acetone, and other solvents. In concentrated sulfuric acid, it is violet-black; when diluted, it is dark greenish-blue and produces a blue to black precipitate. The ethanol solution of the dye is bluish-black when concentrated hydrochloric acid is added and dark blue when concentrated sodium hydroxide solution is added.
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 8.2% (182 of 2225) of reports.
Warning
H341 (90.7%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2225 reports by companies from 6 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: 1H-Perimidine, 2,3-dihydro-2,2-dimethyl-6-[[4-(phenylazo)-1-naphthalenyl]azo]-
1H-Perimidine, 2,3-dihydro-2,2-dimethyl-6-4-(phenylazo)-1-naphthalenylazo-: Does not have an individual approval but may be used under an appropriate group standard
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- SD4431500
- 독성
- LD50 ivn-mus: 63 mg/kg CSLNX* NX#04918
- HS 번호
- 32041900
- risk_code
- 11-36/37/38
- hazard_code
- F,Xi
- safety_code
- 24/25-16-37/39-26
- 위험 등급
- IRRITANT
- 기존화학 물질
- KE-08505
- Hazard Classifications
- Muta. 2
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
약리 정보
용도 및 제조
Uses
Composed of 2 major blue components, SBB-I and SBB-II (defined by this CAS# and name), and at least 12 minor components; Used as a biological stain for lipids; [Merck Index] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]
응용 분야
용도Sudan Black is a basic black dye that is used in staining triglycerides and lipids off some lipoproteins. Biological stain. Dyes and metabolites, Environmental Testing.
제조 방법
aniline diazotization, and Naphthalen-1-amine coupling, and its product to diazotization, and 2,2-Dimethyl-2,3-dihydro-1H-perimidinecoupling.
상·하류 제품 정보
상류 원료
공급사50 곳
추가 설명
정의ChEBI: Sudan black B is a member of the class of perimidines that is 2,2-dimethyl-2,3-dihydro-1H-perimidine carrying a [4-(phenyldiazenyl)naphthalen-1-yl]diazenyl substituent at position 6. A fat-soluble dye predominantly used for demonstrating triglycerides in frozen sections and for staining of protein bound lipids in paraffin sections. It has a role as a histological dye. It is a member of azobenzenes, a bis(azo) compound and a member of perimidines.
관련 반응
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