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2-(2-Aminoethyl)aniline dihydrochloride - 95%, high purity , CAS No.1159823-45-6

COA

Grade & Purity:

≥95%

Cas Number: 1159823-45-6
Molecular Weight: 209.12
PubChem CID: 46738113
PubChem SID: 504770745

In stock

Item Number

A189849

Grouped product items
SKU	Size	Availability	Price
A189849-250mg	250mg	1	$80.90
A189849-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$224.90
A189849-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$773.90

Basic Description

Synonyms	2-(2-Aminoethyl)aniline dihydrochloride \| 1159823-45-6 \| 2-(2-aminoethyl)aniline 2hcl \| 2-(2-amino-ethyl)-phenylamine dihydrochloride \| 2-(2-aminoethyl)aniline;dihydrochloride \| 2-(2-Amino-ethyl)-aniline dihydrochloride \| MFCD09878747 \| Benzeneethanamine, 2-amino-, hyd
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenethylamines

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenethylamines
Intermediate Tree Nodes	Not available
Direct Parent	Phenethylamines
Alternative Parents	Aniline and substituted anilines 2-arylethylamines Aralkylamines Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenethylamine - 2-arylethylamine - Aniline or substituted anilines - Aralkylamine - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
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	504770745
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504770745
IUPAC Name	2-(2-aminoethyl)aniline;dihydrochloride
INCHI	InChI=1S/C8H12N2.2ClH/c9-6-5-7-3-1-2-4-8(7)10;;/h1-4H,5-6,9-10H2;2*1H
InChIKey	KRZZSHRMVZTDTQ-UHFFFAOYSA-N
Smiles	C1=CC=C(C(=C1)CCN)N.Cl.Cl
Isomeric SMILES	C1=CC=C(C(=C1)CCN)N.Cl.Cl
PubChem CID	46738113
Molecular Weight	209.12

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

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Analytical Chart:

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Lot Number	Certificate Type	Date	Item
I2022047	Certificate of Analysis	Jul 13, 2023	A189849

Chemical and Physical Properties

Molecular Weight	209.110 g/mol
XLogP3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	208.053 Da
Monoisotopic Mass	208.053 Da
Topological Polar Surface Area	52.000 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	93.300
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	3

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