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S-(N,N-Dimethylthiocarbamoyl)thioglycolic Acid - >97.0%(T), high purity , CAS No.4007-01-6

COA

Grade & Purity:

≥97%(T)

Cas Number: 4007-01-6
Molecular Weight: 179.25
MDL number: MFCD00021765
PubChem CID: 301695
PubChem SID: 488189382

In stock

Item Number

S161324

Grouped product items
SKU	Size	Availability	Price
S161324-1g	1g	9	$48.90
S161324-5g	5g	5	$187.90
S161324-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$842.90

View related series

Non heterocyclic block (8163) Sulfur containing compounds (986)

Basic Description

Synonyms	S-(N,N-Dimethylthiocarbamoyl)mercaptoacetic Acid
Specifications & Purity	≥97%(T)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Fatty Acyls
    - Subclass Fatty acids and conjugates

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Fatty Acyls
Subclass	Fatty acids and conjugates
Intermediate Tree Nodes	Not available
Direct Parent	Straight chain fatty acids
Alternative Parents	Dithiocarbamic acid esters Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Straight chain fatty acid - Dithiocarbamic acid ester - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Sulfenyl compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as straight chain fatty acids. These are fatty acids with a straight aliphatic chain.
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	488189382
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488189382
IUPAC Name	2-(dimethylcarbamothioylsulfanyl)acetic acid
INCHI	InChI=1S/C5H9NO2S2/c1-6(2)5(9)10-3-4(7)8/h3H2,1-2H3,(H,7,8)
InChIKey	FYGUGMCPHDSCLF-UHFFFAOYSA-N
Smiles	CN(C)C(=S)SCC(=O)O
Isomeric SMILES	CN(C)C(=S)SCC(=O)O
PubChem CID	301695
Molecular Weight	179.25
Reaxy-Rn	1766296

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
L1726077	Certificate of Analysis	Jul 09, 2025	S161324
G1711012	Certificate of Analysis	Jan 22, 2025	S161324
B2107007	Certificate of Analysis	Dec 19, 2024	S161324
E2304410	Certificate of Analysis	May 17, 2023	S161324
E2304409	Certificate of Analysis	May 10, 2023	S161324
H1807085	Certificate of Analysis	Jun 15, 2022	S161324

Chemical and Physical Properties

Melt Point(°C)	150 °C
Molecular Weight	179.300 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	179.007 Da
Monoisotopic Mass	179.007 Da
Topological Polar Surface Area	97.900 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	147.000
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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