Basic Description

Synonyms	2-Hydroxy-9,10-anthracenedione \| EINECS 225-822-9 \| Butanamide, 2,2'-((3,3'-dichloro(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(N-(2,4-dimethylpheny l)-3-oxo- \| Irgalite Yellow BAW \| Monolite Fast Yellow GLV \| Dainichi Benzidine Yellow 2GR \| Saranac Yellow X 2
Specifications & Purity	technical grade
Storage Temp	Room temperature
Shipped In	Normal
Grade	technical grade

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Biphenyls and derivatives
      - Level5 Benzidines
        Level6 3,3'-disubstituted benzidines

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Biphenyls and derivatives
Intermediate Tree Nodes	Benzidines
Direct Parent	3,3'-disubstituted benzidines
Alternative Parents	Polychlorinated biphenyls m-Xylenes Chlorobenzenes Beta-hydroxy ketones Aryl chlorides Azo compounds Propargyl-type 1,3-dipolar organic compounds Carboximidic acids Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	3,3'-disubstituted benzidine - Polychlorinated biphenyl - Chlorinated biphenyl - M-xylene - Xylene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Beta-hydroxy ketone - Azo compound - Ketone - Carboximidic acid - Carboximidic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as 3,3'-disubstituted benzidines. These are organic compounds containing a benzidine skeleton, which is substituted only at the 3- and 3'-positions.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504754704
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754704
IUPAC Name	2-[[2-chloro-4-[3-chloro-4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2,4-dimethylphenyl)-3-oxobutanamide
INCHI	InChI=1S/C36H34Cl2N6O4/c1-19-7-11-29(21(3)15-19)39-35(47)33(23(5)45)43-41-31-13-9-25(17-27(31)37)26-10-14-32(28(38)18-26)42-44-34(24(6)46)36(48)40-30-12-8-20(2)16-22(30)4/h7-18,33-34H,1-6H3,(H,39,47)(H,40,48)
InChIKey	IAFBRPFISOTXSO-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)Cl)Cl)C
Isomeric SMILES	CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)Cl)Cl)C
PubChem CID	73462
Molecular Weight	685.60

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

7 results found

Lot Number	Certificate Type	Date	Item
L2313472	Certificate of Analysis	Nov 23, 2023	P342015
L2313478	Certificate of Analysis	Nov 23, 2023	P342015
L2313470	Certificate of Analysis	Nov 23, 2023	P342015
L2313479	Certificate of Analysis	Nov 23, 2023	P342015
L2313481	Certificate of Analysis	Nov 23, 2023	P342015
L2313482	Certificate of Analysis	Nov 23, 2023	P342015
L2313484	Certificate of Analysis	Nov 23, 2023	P342015

Chemical and Physical Properties

Melt Point(°C)	347-351° C
Molecular Weight	685.600 g/mol
XLogP3	9.500
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	11
Exact Mass	684.202 Da
Monoisotopic Mass	684.202 Da
Topological Polar Surface Area	142.000 Å²
Heavy Atom Count	48
Formal Charge	0
Complexity	1110.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Meng Wang, Zaiyu Wang, Wei Ma, Shan-Ci Chen, Qingdong Zheng. (2016) Indenothiophene-Based Wide Bandgap Copolymer for Polymer Fullerene Solar Cells with 9.01% Efficiency and 1.0 V Open Circuit Voltage. Advanced Electronic Materials, 2 (11): (1600340).

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SKU	Size	Availability	Price
P342015-1g	1g	4	$39.90
P342015-5g	5g	3	$118.90
P342015-25g	25g	2	$398.90
P342015-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,128.90

Pigment Yellow 13 - Industrial grade, high purity , CAS No.5102-83-0