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3-Chloro-2-(chloromethyl)-4-methylquinoline, HCl - 95%, high purity , CAS No.37781-33-2

COA

Grade & Purity:

≥95%

Cas Number: 37781-33-2
Molecular Weight: 262.6
PubChem CID: 16246596

In stock

Item Number

C184131

Grouped product items
SKU	Size	Availability	Price	Qty
C184131-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,790.90
C184131-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,925.90

Basic Description

Synonyms	3-chloro-2-(chloromethyl)-4-methylquinoline hydrochloride \| 37781-33-2 \| 3-Chloro-2-(chloromethyl)-4-methylquinolinehydrochloride \| 1009306-54-0 \| 3-CHLORO-2-(CHLOROMETHYL)-4-METHYLQUINOLINE, HCL \| 3-chloro-2-(chloromethyl)-4-methylquinoline;hydrochloride \| DTXSID205
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Quinolines and derivatives
    - Subclass Haloquinolines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Quinolines and derivatives
Subclass	Haloquinolines
Intermediate Tree Nodes	Not available
Direct Parent	Chloroquinolines
Alternative Parents	Methylpyridines Benzenoids Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Chloroquinoline - Methylpyridine - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrochloride - Alkyl chloride - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as chloroquinolines. These are compounds containing a quinoline moiety, which carries one or more chlorine 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

IUPAC Name	3-chloro-2-(chloromethyl)-4-methylquinoline;hydrochloride
INCHI	InChI=1S/C11H9Cl2N.ClH/c1-7-8-4-2-3-5-9(8)14-10(6-12)11(7)13;/h2-5H,6H2,1H3;1H
InChIKey	GPLQWAVBVGCDBW-UHFFFAOYSA-N
Smiles	CC1=C(C(=NC2=CC=CC=C12)CCl)Cl.Cl
Isomeric SMILES	CC1=C(C(=NC2=CC=CC=C12)CCl)Cl.Cl
PubChem CID	16246596
Molecular Weight	262.6

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	262.600 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	260.988 Da
Monoisotopic Mass	260.988 Da
Topological Polar Surface Area	12.900 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	198.000
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	2

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