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2-(((2-((Dimethylamino)methyl)thiazol-4-yl)methyl)thio)ethanamine - ≥97%, high purity , CAS No.78441-62-0

COA

Grade & Purity:

≥97%

Cas Number: 78441-62-0
Molecular Weight: 231.38
PubChem CID: 10977318

In stock

Item Number

M725327

Grouped product items
SKU	Size	Availability	Price
M725327-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$18.90
M725327-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$42.90
M725327-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$132.90
M725327-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$216.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Thiazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Thiazoles
Intermediate Tree Nodes	Not available
Direct Parent	2,4-disubstituted thiazoles
Alternative Parents	Aralkylamines Heteroaromatic compounds Trialkylamines Sulfenyl compounds Dialkylthioethers Azacyclic compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2,4-disubstituted 1,3-thiazole - Aralkylamine - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Thioether - Azacycle - Sulfenyl compound - Dialkylthioether - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Amine - Primary aliphatic amine - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 2,4-disubstituted thiazoles. These are compounds containing a thiazole ring substituted at the positions 2 and 3.
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-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethanamine
INCHI	InChI=1S/C9H17N3S2/c1-12(2)5-9-11-8(7-14-9)6-13-4-3-10/h7H,3-6,10H2,1-2H3
InChIKey	FDMDNIIUCZHKFE-UHFFFAOYSA-N
Smiles	CN(C)CC1=NC(=CS1)CSCCN
Isomeric SMILES	CN(C)CC1=NC(=CS1)CSCCN
PubChem CID	10977318
Molecular Weight	231.38

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	231.400 g/mol
XLogP3	0.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	231.086 Da
Monoisotopic Mass	231.086 Da
Topological Polar Surface Area	95.700 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	155.000
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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