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2-(5-Chloro-2-thienyl)pyrrolidine - ≥99%, high purity , CAS No.524674-42-8

COA

Grade & Purity:

≥99%

Cas Number: 524674-42-8
Molecular Weight: 187.69
PubChem CID: 4305829

In stock

Item Number

P709132

Grouped product items
SKU	Size	Availability	Price	Qty
P709132-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,955.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Not available
Direct Parent	Aralkylamines
Alternative Parents	2,5-disubstituted thiophenes Aryl chlorides Pyrrolidines Heteroaromatic compounds Dialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aralkylamine - 2,5-disubstituted thiophene - Aryl halide - Aryl chloride - Heteroaromatic compound - Thiophene - Pyrrolidine - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
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-(5-chlorothiophen-2-yl)pyrrolidine
INCHI	InChI=1S/C8H10ClNS/c9-8-4-3-7(11-8)6-2-1-5-10-6/h3-4,6,10H,1-2,5H2
InChIKey	XMSYAIXTGCQRQX-UHFFFAOYSA-N
Smiles	C1CC(NC1)C2=CC=C(S2)Cl
Isomeric SMILES	C1CC(NC1)C2=CC=C(S2)Cl
PubChem CID	4305829
Molecular Weight	187.69

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	187.690 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	187.022 Da
Monoisotopic Mass	187.022 Da
Topological Polar Surface Area	40.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	142.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
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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2-(5-Chloro-2-thienyl)pyrrolidine - ≥99%, high purity , CAS No.524674-42-8

Basic Description