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6-(Dibutylamino)-1,3,5-triazine-2,4-dithiol - >98.0%, high purity , CAS No.29529-99-5

COA

Grade & Purity:

≥98%

Cas Number: 29529-99-5
Molecular Weight: 272.43
MDL number: MFCD00272594
PubChem CID: 3035346

In stock

Item Number

D155487

Grouped product items
SKU	Size	Availability	Price
D155487-5g	5g	4	$9.90
D155487-25g	25g	4	$28.90
D155487-100g	100g	6	$82.90
D155487-500g	500g	1	$289.90

View related series

Six-Membered Heterocyclic Compounds (1696) triazines (92)

Basic Description

Synonyms	AS-65788 \| D3265 \| 2-(Dibutylamino)-4,6-dimercapto-1,3,5-triazine \| 2-dibutylamino-1,3,5-triazine-4,6-dithiol \| EINECS 249-682-3 \| A819947 \| DTXSID0067478 \| 6-(dibutylamino)-1H-1,3,5-triazine-2,4-dithione \| 2-Methyl-5-chloroquinline \| SB73249 \| 6-(Dibutyl
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines
      - Level5 Tertiary amines
        Level6 Tertiary alkylarylamines
        Level7 Dialkylarylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Tertiary amines - Tertiary alkylarylamines
Direct Parent	Dialkylarylamines
Alternative Parents	Triazinethiones N-aliphatic s-triazines 1,3,5-triazines Heteroaromatic compounds Thioureas Azacyclic compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Dialkylarylamine - N-aliphatic s-triazine - Triazinethione - Aminotriazine - Amino-1,3,5-triazine - 1,3,5-triazine - Triazine - Heteroaromatic compound - Thiourea - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as dialkylarylamines. These are aliphatic aromatic amines in which the amino group is linked to two aliphatic chains and one aromatic group.
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	6-(dibutylamino)-1H-1,3,5-triazine-2,4-dithione
INCHI	InChI=1S/C11H20N4S2/c1-3-5-7-15(8-6-4-2)9-12-10(16)14-11(17)13-9/h3-8H2,1-2H3,(H2,12,13,14,16,17)
InChIKey	IXDGHAZCSMVIFX-UHFFFAOYSA-N
Smiles	CCCCN(CCCC)C1=NC(=S)NC(=S)N1
Isomeric SMILES	CCCCN(CCCC)C1=NC(=S)NC(=S)N1
Molecular Weight	272.43
Reaxy-Rn	46085320
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=46085320&ln=

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

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6 results found

Lot Number	Certificate Type	Date	Item
D1912073	Certificate of Analysis	Feb 03, 2023	D155487
E2227203	Certificate of Analysis	May 19, 2022	D155487
A2218379	Certificate of Analysis	Dec 25, 2021	D155487
A2218380	Certificate of Analysis	Dec 25, 2021	D155487
A2218381	Certificate of Analysis	Dec 25, 2021	D155487
A2218382	Certificate of Analysis	Dec 25, 2021	D155487

Chemical and Physical Properties

Melt Point(°C)	143 °C
Molecular Weight	272.400 g/mol
XLogP3	2.800
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	272.113 Da
Monoisotopic Mass	272.113 Da
Topological Polar Surface Area	104.000 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	307.000
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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