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2-Amino-5，7-dihydro-4H-thieno[2，3-c]pyran-3-carboxamide - ≥95%, high purity , CAS No.848324-33-4

COA

Grade & Purity:

≥95%

Cas Number: 848324-33-4
Molecular Weight: 198.25
PubChem CID: 43608773

In stock

Item Number

A731965

Grouped product items
SKU	Size	Availability	Price	Qty
A731965-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$231.90
A731965-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$460.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Thienopyrans

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Thienopyrans
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Thienopyrans
Alternative Parents	3,4,5-trisubstituted-2-aminothiophenes Thiophene carboxamides Pyrans Vinylogous amides Heteroaromatic compounds Primary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Thienopyran - 3,4,5-trisubstituted-2-aminothiophene - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Pyran - 2-aminothiophene - Heteroaromatic compound - Thiophene - Vinylogous amide - Primary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as thienopyrans. These are heterocyclic compounds containing a thiophene ring fused to a pyran ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds.
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-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide
INCHI	InChI=1S/C8H10N2O2S/c9-7(11)6-4-1-2-12-3-5(4)13-8(6)10/h1-3,10H2,(H2,9,11)
InChIKey	NXXFLPNSJIRRSJ-UHFFFAOYSA-N
Smiles	C1COCC2=C1C(=C(S2)N)C(=O)N
Isomeric SMILES	C1COCC2=C1C(=C(S2)N)C(=O)N
PubChem CID	43608773
Molecular Weight	198.25

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

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

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	222-223
Molecular Weight	198.240 g/mol
XLogP3	0.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	198.046 Da
Monoisotopic Mass	198.046 Da
Topological Polar Surface Area	107.000 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	224.000
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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