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Disperse Red 13 methacrylate - 98%, high purity , CAS No.82701-58-4

COA

Grade & Purity:

≥98%

Cas Number: 82701-58-4
Molecular Weight: 416.86
MDL number: MFCD04040790
PubChem CID: 5146818

In stock

Item Number

D472655

Grouped product items
SKU	Size	Availability	Price	Qty
D472655-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$942.90

Basic Description

Synonyms	2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl 2-methylprop-2-enoate \| SCHEMBL10039826 \| 2-((4-((2-Chloro-4-nitrophenyl)azo)phenyl)ethylamino)ethyl methacrylate \| Disperse Red 13 methacrylate \| DTXSID201037490 \| DISPERSE RED 13 METHACRYLATE9
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	NLO material

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azobenzenes

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azobenzenes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Azobenzenes
Alternative Parents	Nitrobenzenes Aniline and substituted anilines Nitroaromatic compounds Dialkylarylamines Chlorobenzenes Aryl chlorides Enoate esters Amino acids and derivatives Azo compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic cations
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Azobenzene - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Tertiary amine - Azo compound - Amino acid or derivatives - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organic salt - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organic cation - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as azobenzenes. These are organonitrogen aromatic compounds that contain a central azo group, where each nitrogen atom is conjugated to a benzene ring.
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

IUPAC Name	2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl 2-methylprop-2-enoate
INCHI	InChI=1S/C20H21ClN4O4/c1-4-24(11-12-29-20(26)14(2)3)16-7-5-15(6-8-16)22-23-19-10-9-17(25(27)28)13-18(19)21/h5-10,13H,2,4,11-12H2,1,3H3
InChIKey	UJXGDBTUUWCZLZ-UHFFFAOYSA-N
Smiles	CCN(CCOC(=O)C(=C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl
Isomeric SMILES	CCN(CCOC(=O)C(=C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl
Molecular Weight	416.86
Reaxy-Rn	24683749
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24683749&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Flash Point(°F)	Not applicable
Flash Point(°C)	Not applicable
Melt Point(°C)	66-71℃ (lit.)
Molecular Weight	416.900 g/mol
XLogP3	5.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	9
Exact Mass	416.125 Da
Monoisotopic Mass	416.125 Da
Topological Polar Surface Area	100.000 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	602.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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