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2-Chloro-5-methoxyaniline hydrochloride - ≥98.0%(HPLC), high purity , CAS No.85006-21-9

COA

Grade & Purity:

≥98%(HPLC)

Cas Number: 85006-21-9
Molecular Weight: 194.06
Beilstein Registry Number: 13(4)999
MDL number: MFCD00012962
PubChem CID: 2723900
PubChem SID: 504760828

In stock

Item Number

C134554

Grouped product items
SKU	Size	Availability	Price
C134554-1g	1g	3	$14.90
C134554-5g	5g	2	$54.90
C134554-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$164.90
C134554-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$591.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	J-508856 \| PS-8309 \| 2-Chloro-5-methoxyaniline--hydrogen chloride (1/1) \| FT-0621077 \| 2-Chloro-5-methoxyaniline hydrochloride \| 2-Chloro-5-methoxyanilineHydrochloride \| 2-chloro-5-methoxyaniline-hydrochloride \| 2-chloro-5-methoxyaniline;hydrochloride \| 6
Specifications & Purity	≥98%(HPLC)
Shipped In	Normal
Product Description	It may be used in chemical synthesis studies.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers
    - Subclass Aminophenyl ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Aminophenyl ethers
Intermediate Tree Nodes	Not available
Direct Parent	Aminophenyl ethers
Alternative Parents	Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Chlorobenzenes Alkyl aryl ethers Aryl chlorides Primary amines Organopnictogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Ether - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organooxygen compound - Primary amine - Hydrochloride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminophenyl ethers. These are aromatic compounds that contain a phenol ether, which carries an amine group on the benzene ring.
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

Pubchem Sid	504760828
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504760828
IUPAC Name	2-chloro-5-methoxyaniline;hydrochloride
INCHI	InChI=1S/C7H8ClNO.ClH/c1-10-5-2-3-6(8)7(9)4-5;/h2-4H,9H2,1H3;1H
InChIKey	NQWBPXKJBZYGHZ-UHFFFAOYSA-N
Smiles	COC1=CC(=C(C=C1)Cl)N.Cl
Isomeric SMILES	COC1=CC(=C(C=C1)Cl)N.Cl
WGK Germany	3
Molecular Weight	194.06
Beilstein	13(4)999
Reaxy-Rn	3699386
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3699386&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number	Certificate Type	Date	Item
K2309128	Certificate of Analysis	Oct 16, 2023	C134554
K2309111	Certificate of Analysis	Oct 16, 2023	C134554
K2309037	Certificate of Analysis	Oct 16, 2023	C134554
K2309034	Certificate of Analysis	Oct 16, 2023	C134554
I1507018	Certificate of Analysis	Mar 16, 2023	C134554

Chemical and Physical Properties

Melt Point(°C)	207 °C
Molecular Weight	194.060 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	193.006 Da
Monoisotopic Mass	193.006 Da
Topological Polar Surface Area	35.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	110.000
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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