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3，6-Dihydro-2H-thiopyran - ≥95%, high purity , CAS No.40697-99-2

COA

Grade & Purity:

≥95%

Cas Number: 40697-99-2
Molecular Weight: 100.18
MDL number: MFCD30489762
PubChem CID: 567880

In stock

Item Number

D770524

Grouped product items
SKU	Size	Availability	Price
D770524-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$125.90
D770524-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$247.90
D770524-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$743.90

Basic Description

Specifications & Purity	≥95%
Storage Temp	Room temperature,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Thiopyrans

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Thiopyrans
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Thiopyrans
Alternative Parents	Dialkylthioethers Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Thiopyran - Dialkylthioether - Thioether - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as thiopyrans. These are compounds containing a six-member aliphatic heterocycle made up of one sulfur atom and five 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

INCHI	InChI=1S/C5H8S/c1-2-4-6-5-3-1/h1-2H,3-5H2
InChIKey	UNVYSECOIMWWKM-UHFFFAOYSA-N
Smiles	C1CSCC=C1
Isomeric SMILES	C1CSCC=C1
Molecular Weight	100.18

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	100.180 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	100.035 Da
Monoisotopic Mass	100.035 Da
Topological Polar Surface Area	25.300 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	57.000
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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