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4-Imidazoledithiocarboxylic acid - 70%, technical grade, high purity , CAS No.84824-76-0

COA

Grade & Purity:

technical grade

≥70%

Cas Number: 84824-76-0
Molecular Weight: 144.22
EC Number: 284-227-2
MDL number: MFCD03428062
PubChem CID: 3020150
PubChem SID: 488194185

In stock

Item Number

I139315

Grouped product items
SKU	Size	Availability	Price	Qty
I139315-1g	1g	3	$11.90
I139315-5g	5g	1	$45.90

Discover 4-Imidazoledithiocarboxylic acid by Aladdin Scientific in 70%, technical grade for only $11.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1H-Imidazole-4-carbodithioic acid \| 84824-76-0 \| 4-Imidazoledithiocarboxylic acid \| 1H-imidazole-5-carbodithioic acid \| 4(5)-Imidazoledithiocarboxylic acid \| 5-Imidazoledithiocarboxylic acid \| EINECS 284-227-2 \| SCHEMBL669943 \| SCHEMBL12997950 \| 1H-Imidazole-4-carbodithioi
Specifications & Purity	technical grade, ≥70%
Shipped In	Normal
Grade	technical grade

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Imidazoles
Intermediate Tree Nodes	Not available
Direct Parent	Imidazoles
Alternative Parents	Heteroaromatic compounds Azacyclic compounds Alkylthiols Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - Imidazole - Azacycle - Alkylthiol - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as imidazoles. These are compounds containing an imidazole ring, which is an aromatic five-member ring with two nitrogen atoms at positions 1 and 3, and three carbon atoms.
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	488194185
IUPAC Name	1H-imidazole-5-carbodithioic acid
INCHI	InChI=1S/C4H4N2S2/c7-4(8)3-1-5-2-6-3/h1-2H,(H,5,6)(H,7,8)
InChIKey	RAUHREXYGRKIOJ-UHFFFAOYSA-N
Smiles	C1=C(NC=N1)C(=S)S
Isomeric SMILES	C1=C(NC=N1)C(=S)S
WGK Germany	3
Molecular Weight	144.22
Reaxy-Rn	6643204
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6643204&ln=

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

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Analytical Chart:

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Lot Number	Certificate Type	Date	Item
G1922258	Certificate of Analysis	Mar 14, 2023	I139315

Chemical and Physical Properties

Molecular Weight	144.200 g/mol
XLogP3	1.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	143.982 Da
Monoisotopic Mass	143.982 Da
Topological Polar Surface Area	61.800 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	104.000
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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