Grundinformationen
- Standard-SMILES
CC1(C)Nc2cccc3c(N=Nc4ccc(N=Nc5ccccc5)c5ccccc45)ccc(c23)N1- InChIKey
YCUVUDODLRLVIC-UHFFFAOYSA-N- Summenformel
- C29H24N6
- Durchschnittliche Molmasse
- 456,5 g/mol
- Monoisotopische Masse
- 456,20624477
Überblick
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.
Namen und Bezeichner
- Bevorzugter Name
- Sudan Black B
- IUPAC
- (2,2-dimethyl-1,3-dihydroperimidin-6-yl)-(4-phenyldiazenylnaphthalen-1-yl)diazene
- Lokaler Name
- 2,3-Dihydro-2,2-dimethyl-6-[[1-naphthyl-4-(phenylazo)]azo]-1H-perimidin
- Englischer Name
- Solvent Black 3
- Summenformel
- C29H24N6
- Molmasse
- 456.54
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
4197-25-5- PubChem CID
- 61336
- DTXSID
DTXSID0052091- ChEMBL
CHEMBL1872445- ChEBI
CHEBI:88216- UNII
- 9YDL1Q990E
- EC Number
- 224-087-1
- Nikkaji
- J34.104E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 8,4
- Polarare Oberfläche (TPSA)
- 73,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 35
- Formalladung
- 0
- Komplexität
- 773
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 120 · 120-124 °C(lit.)
- Siedepunkt
- 552.68 °C · 552.68°C (rough estimate)
- Dichte
- 1.4899 · 1.4899 (rough estimate)
- Brechungsindex
- 1.457 · 1.4570 (estimate)
- storage temp.
- Store at RT.
- Löslichkeit
- Insoluble in water; soluble in ethanol, acetone, benzene, toluene, xylene, ethylene glycol
- pka
- 2.94 · 2.94±0.40(Predicted)
- Aggregatzustand
- Powder/Solid
- Farbe
- Very dark brown to black
- Wasserlöslichkeit
- Soluble in oils, fats, warm petrolatum, paraffin, phenol, ethanol, acetone, benzene, toluene and hydrocarbon. Insoluble in water.
- Merck
- 13 · 13,8970
- BRN
- 723248 · 723248
- Stabilität
- Light Sensitive
- Major Application
- diagnostic assay manufacturinghematologyhistology
- Kosmetik-Inhaltsstoffe Funktionen
- HAIR DYEING
- 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
- CAS Datenbank
- 4197 · 4197-25-5(CAS DataBase Reference)
- EPA chemische Informationen
- 3 · C.I. Solvent Black 3 (4197-25-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
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.
Gefahrenhinweise
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
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 32041900
- RTECS-Nr.
- SD4431500
- risk_code
- 11-36/37/38
- Toxizität
- LD50 ivn-mus: 63 mg/kg CSLNX* NX#04918
- hazard_code
- F,Xi
- safety_code
- 24/25-16-37/39-26
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Muta. 2
Chemie und Industrie
Pharmakologische Informationen
Verwendung und Herstellung
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]
Anwendungen
VerwendenSudan Black is a basic black dye that is used in staining triglycerides and lipids off some lipoproteins. Biological stain. Dyes and metabolites, Environmental Testing.
Darstellung
synthetischeaniline diazotization, and Naphthalen-1-amine coupling, and its product to diazotization, and 2,2-Dimethyl-2,3-dihydro-1H-perimidinecoupling.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter50 Anbieter
Ergänzende Hinweise
DefinitionChEBI: 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.
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