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4,4'-(2,3-Dihydrothieno[3,4-b][1,4]dioxine-5,7-diyl)bis[N,N-bis(4-methoxyphenyl)aniline] - 95%, high purity , CAS No.1622008-73-4

COA

Grade & Purity:

≥95%

Cas Number: 1622008-73-4
Molecular Weight: 748.89
PubChem CID: 102130343
PubChem SID: 488202602

In stock

Item Number

D154707

Grouped product items
SKU	Size	Availability	Price
D154707-50mg	50mg	3	$49.90
D154707-250mg	250mg	4	$206.90
D154707-1g	1g	2	$556.90

View related series

Five-Membered Heterocyclic Compounds (2064) Fused ring thiophenes (57)

Basic Description

Synonyms	H101
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines
      - Level5 Tertiary amines
        Level6 Triarylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Tertiary amines
Direct Parent	Triarylamines
Alternative Parents	Methoxyanilines Aminophenyl ethers Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Para dioxins Thiophenes Heteroaromatic compounds Oxacyclic compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Tertiary aromatic amine - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Para-dioxin - Benzenoid - Heteroaromatic compound - Thiophene - Oxacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as triarylamines. These are organic compounds containing a trialkylamine group, characterized by exactly three aryl groups bonded to the amino nitrogen.
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	488202602
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488202602
IUPAC Name	4-[5-[4-(4-methoxy-N-(4-methoxyphenyl)anilino)phenyl]-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-N,N-bis(4-methoxyphenyl)aniline
INCHI	InChI=1S/C46H40N2O6S/c1-49-39-21-13-35(14-22-39)47(36-15-23-40(50-2)24-16-36)33-9-5-31(6-10-33)45-43-44(54-30-29-53-43)46(55-45)32-7-11-34(12-8-32)48(37-17-25-41(51-3)26-18-37)38-19-27-42(52-4)28-20-38/h5-28H,29-30H2,1-4H3
InChIKey	JOJPNOVYPGLCMM-UHFFFAOYSA-N
Smiles	COC1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=C4C(=C(S3)C5=CC=C(C=C5)N(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)OCCO4)C8=CC=C(C=C8)OC
Isomeric SMILES	COC1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=C4C(=C(S3)C5=CC=C(C=C5)N(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)OCCO4)C8=CC=C(C=C8)OC
Molecular Weight	748.89
Reaxy-Rn	27052497
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27052497&ln=

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

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

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
G2301289	Certificate of Analysis	May 26, 2023	D154707
G2301292	Certificate of Analysis	May 26, 2023	D154707
G2301296	Certificate of Analysis	May 26, 2023	D154707
G2301300	Certificate of Analysis	May 26, 2023	D154707
F2507075	Certificate of Analysis	May 26, 2023	D154707
G2301297	Certificate of Analysis	May 26, 2023	D154707
G2301295	Certificate of Analysis	May 26, 2023	D154707

Chemical and Physical Properties

Molecular Weight	748.900 g/mol
XLogP3	11.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	12
Exact Mass	748.261 Da
Monoisotopic Mass	748.261 Da
Topological Polar Surface Area	90.100 Å²
Heavy Atom Count	55
Formal Charge	0
Complexity	985.000
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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