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5-bromo-1,2,3,6-tetrahydropyridine;hydrochloride - 97%, high purity , CAS No.1803581-46-5

COA

Grade & Purity:

≥97%

Cas Number: 1803581-46-5
MDL number: MFCD28098126
PubChem CID: 86767467

In stock

Item Number

B630556

Grouped product items
SKU	Size	Availability	Price
B630556-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$140.90
B630556-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$224.90
B630556-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$374.90
B630556-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$561.90
B630556-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,811.90

Basic Description

Synonyms	1803581-46-5 \| 5-Bromo-1,2,3,6-tetrahydro-pyridine hydrochloride \| 5-bromo-1,2,3,6-tetrahydropyridine hydrochloride \| 5-bromo-1,2,3,6-tetrahydropyridine \| hydrochloride \| MFCD28098126 \| SB34425 \| AS-79388 \| D97153 \| EN300-200018 \| 5-BROMO-1,2,3,6-TETRAHYD
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Hydropyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Hydropyridines
Intermediate Tree Nodes	Not available
Direct Parent	Hydropyridines
Alternative Parents	Vinyl bromides Dialkylamines Bromoalkenes Azacyclic compounds Organobromides Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Hydropyridine - Secondary aliphatic amine - Azacycle - Secondary amine - Bromoalkene - Haloalkene - Vinyl halide - Vinyl bromide - Amine - Hydrochloride - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as hydropyridines. These are compounds containing a hydrogenated pyridine ring (i.e. containing less than the maximum number of 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	5-bromo-1,2,3,6-tetrahydropyridine;hydrochloride
INCHI	InChI=1S/C5H8BrN.ClH/c6-5-2-1-3-7-4-5;/h2,7H,1,3-4H2;1H
InChIKey	YXGOREDHMPAAQD-UHFFFAOYSA-N
Smiles	C1CNCC(=C1)Br.Cl
Isomeric SMILES	C1CNCC(=C1)Br.Cl
PubChem CID	86767467

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	198.490 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	196.961 Da
Monoisotopic Mass	196.961 Da
Topological Polar Surface Area	12.000 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	88.100
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	2

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