Vat blue 6

Base Information

• Chemical Name: Vat blue 6
• CAS No.: 130-20-1
• Deprecated CAS: 39456-82-1,57284-96-5,61356-48-7,79079-57-5,94556-02-2,727741-47-1,57284-96-5,61356-48-7,79079-57-5,94556-02-2
• Molecular Formula: C28H12Cl2N2O4
• Molecular Weight: 511.32
• Hs Code.: 2933990090
• European Community (EC) Number: 204-980-2,814-884-8,841-177-1
• NSC Number: 74700
• UNII: UBL2KQB85Q
• DSSTox Substance ID: DTXSID9044532
• Nikkaji Number: J92.774K
• Wikidata: Q27291000
• NCI Thesaurus Code: C71645
• ChEMBL ID: CHEMBL2001164
• Mol file: 130-20-1.mol

Synonyms:VAT BLUE 6;130-20-1;Ahcovat Blue BCF;C.I. Vat Blue 6;D&C Blue No. 9;3,3'-Dichloroindanthrene;Alizanthrene Blue RC;Carbanthrene Blue BCF;Navinon Blue BC;Dichloroindanthrone;Ponsol Blue BF;Cibanone Blue FG;Cibanone Blue GF;Paradone Blue RC;Ponsol Blue BCS;Ponsol Blue BFD;Ponsol Blue BFN;Ponsol Blue BFP;Tinon Blue GF;Tinon Blue GL;Fenan Blue BCS;Vat Green B;Blue K;Caledon Blue XRC;Benzadone Blue RC;Ponsol Blue BFDP;Ponsol Blue BFND;Solanthrene Blue B;Vat Blue K;Vat Blue KD;Cibanone Blue FGF;Cibanone Blue FGL;Atic Vat Blue BC;Fenanthren Blue BC;Fenanthren Blue BD;Indanthren Blue BC;Indo Blue B-I;Mikethrene Blue BC;3,3'-Dichloroindanthrone;7,16-Dichloroindanthrone;Calcoloid Blue BLC;Calcoloid Blue BLD;Calcoloid Blue BLR;5,9,14,18-Anthrazinetetrone, 7,16-dichloro-6,15-dihydro-;Helanthrene Blue BC;Indanthrene Blue BC;Nihonthrene Blue BC;Palanthrene Blue BC;Pernithrene Blue BC;Sandothrene Blue NG;Solanthrene Blue SB;Amanthrene Blue BCL;Indanthren Blue BCA;Indanthren Blue BCS;Mikethrene Blue BCS;Nyanthrene Blue BFP;Ostanthren Blue BCL;Ostanthren Blue BCS;Romantrene Blue FBC;Vat Fast Blue BCS;Calcoloid Blue BLFD;Indanthrene Blue BCF;Palanthrene Blue BCA;Romanthrene Blue FBC;Sandothrene Blue NGR;Sandothrene Blue NGW;CI Vat Blue 6;Carbanthrene Blue BCS;Carbanthrene Blue RCS;Carbanthrene Blue RBCF;D&C Blue 9;Solanthrene Blue F-SBA;Monolite Fast Blue 2RV;Intravat Blue GF;D and C Blue No. 9;Vat Sky Blue K;Vat Sky Blue KD;7,16-Dichlorodinaphtho[2,3-a:2',3'-h]phenazine-5,9,14,18(6H,15H)-tetraone;Monolite Fast Blue 2RVSA;Navinon Brilliant Blue RCL;Harmone B 79;Carbantarene Blue BCF;C.I. 69825;Indotoner Blue B 79;Nihonthrene Brilliant Blue RCL;Indo Blue WD 279;Vat Sky Blue KP 2F;7:16-Dichloro-6:15-indanthrone;Resinated Indo Blue B 85;NSC 74700;C.i.var blue 6;CI 69825;HSDB 2933;NSC74700;EINECS 204-980-2;UNII-UBL2KQB85Q;NSC-74700;UBL2KQB85Q;BRN 0068486;CCRIS 9493;DTXSID9044532;7,16-Dichloro-6,15-dihydro-5,9,14,18-anthrazinetetrone;7,16-Dichloro-6,15-dihydroanthrazine-5,9,14,18-tetrone;4-24-00-02195 (Beilstein Handbook Reference);5,9,14,18-Anthrazinetetrone, 7,16-dichloro-6,15-dihydro-,;15,30-dichloro-2,17-diazaheptacyclo[16.12.0.03,16.04,13.06,11.019,28.021,26]triaconta-1(30),3,6,8,10,13,15,18,21,23,25,28-dodecaene-5,12,20,27-tetrone;C28H12Cl2N2O4;dichloro[?]tetrone;Harmone B.79;VATBLUE6;Indotoner Blue B-79;CARBANTHRENE BLUE;Indo Blue WD-279;3, 3'-Dichloroindanthrone;Resinated Indo Blue B-85;Color Index No. 69825;Color Index Number 69825;VAT BLUE 6 [HSDB];Colour Index No. 69825;Colour Index Number 69825;SCHEMBL342102;AO204 [INCI];BLUE NO. 204;CHEMBL2001164;DTXCID7024532;AO204;CI 69825 [INCI];Tox21_302231;C28-H12-Cl2-N2-O4;MFCD00046965;STK031750;AKOS000283016;INDANTHRENE, 7,16-DICHLORO-;NCGC00255878-01;CAS-130-20-1;LS-20726;NCI60_041636;C.I.69825;FT-0701395;H10897;Q27291000;5,14,18-Anthrazinetetrone, 7,16-dichloro-6,15-dihydro-;7,16-dichloro-6,15-dihydro-5,9,14,18-anthrazine-tetrone;7, 16- dichloro- 6, 15- dihydroanthrazine- 5, 9, 14, 18- tetrone;7,16-dichloro-6,15-dihydrodinaphtho[2,3-a:2',3'-h]phenazine-5,9,14,18-tetrone;7,16-Dichlorodinaphtho[2,3-a:2',3'-h]-phenazine-5,9,14,18(6H,15H)-tetraone;C.I. Vat blue 6: 7,16-Dichloro- 6,15-dihydro- 5,9,14,18-anthrazinetetrone;7,16-DICHLORO-6,15-DIHYDRO-DINAPHTHO(2,3-A,2',3'-H)PHENAZINE-5,9,14,18-TETRAONE

Chemical Property of Vat blue 6

Chemical Property:

• Vapor Pressure: 7.83E-25mmHg at 25°C
• Refractive Index: 1.746
• Boiling Point: 788.5 °C at 760 mmHg
• PKA: -4.66±0.20(Predicted)
• Flash Point: 430.6 °C
• PSA: 99.86000
• Density: 1.591 g/cm³
• LogP: 5.44740
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 510.0174123
• Heavy Atom Count: 36
• Complexity: 926

Purity/Quality:

99.9% ^*data from raw suppliers

Vat Blue 6 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Dyes -> Anthraquinone Dyes
• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=CC(=C4C(=C3C2=O)NC5=C(C=C6C(=C5N4)C(=O)C7=CC=CC=C7C6=O)Cl)Cl
• Uses: C.I.Var Blue 6 (CAS# 130-20-1) is a vat dye used for cotton fabrics dyeing. Materials dyed with C.I.Var Blue 6 have enhanced adsorption of metals and nanoparticles, useful for the preparation of materials for wastewater cleanup.

Technology Process of Vat blue 6

There total 7 articles about Vat blue 6 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 99.8%

6,15-dihydroanthrazine-5,9,14,18-tetrone (81-77-6,88507-35-1) → 7,16-dichloro-6,15-dihydroanthrazine-5,9,14,18-tetrone (130-20-1)

Guidance literature:

With sulfuryl dichloride; In chlorobenzene; at 30 - 112 ℃; for 6h; Temperature; Solvent;

Reference yield:

2-amino-1,3-dichloro-anthraquinone (6374-76-1) → 7,16-dichloro-6,15-dihydroanthrazine-5,9,14,18-tetrone (130-20-1)

Guidance literature:

With copper(l) iodide;

Reference yield:

→ 7,16-dichloro-6,15-dihydroanthrazine-5,9,14,18-tetrone (130-20-1)

Guidance literature:

With chlorine;

upstream raw materials:

2-amino-1,3-dichloro-anthraquinone

2-amino-1-bromo-3-chloro-anthraquinone

N-(3-chloro-9,10-dioxo-9,10-dihydro-[2]anthryl)-acetamide

6,15-dihydroanthrazine-5,9,14,18-tetrone

Refernces