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2-Hydroxy-2，2-di(thiophen-2-yl)acetic acid - ≥97%, high purity , CAS No.4746-63-8

COA

Grade & Purity:

≥97%

Cas Number: 4746-63-8
Molecular Weight: 240.3
EC Number: 829-599-4
PubChem CID: 12723754

In stock

Item Number

H727063

Grouped product items
SKU	Size	Availability	Price
H727063-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$201.90
H727063-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$302.90
H727063-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$756.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Hydroxy acids and derivatives
    - Subclass Alpha hydroxy acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Hydroxy acids and derivatives
Subclass	Alpha hydroxy acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Alpha hydroxy acids and derivatives
Alternative Parents	Thiophenes Tertiary alcohols Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Alpha-hydroxy acid - Tertiary alcohol - Thiophene - Heteroaromatic compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Aromatic alcohol - Organic oxygen compound - Alcohol - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as alpha hydroxy acids and derivatives. These are organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon.
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-hydroxy-2,2-dithiophen-2-ylacetic acid
INCHI	InChI=1S/C10H8O3S2/c11-9(12)10(13,7-3-1-5-14-7)8-4-2-6-15-8/h1-6,13H,(H,11,12)
InChIKey	FVEJUHUCFCAYRP-UHFFFAOYSA-N
Smiles	C1=CSC(=C1)C(C2=CC=CS2)(C(=O)O)O
Isomeric SMILES	C1=CSC(=C1)C(C2=CC=CS2)(C(=O)O)O
Alternate CAS	4746-63-8
PubChem CID	12723754
Molecular Weight	240.3

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	240.300 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	239.991 Da
Monoisotopic Mass	239.991 Da
Topological Polar Surface Area	114.000 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	241.000
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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