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2-Amino-5-chlorobenzonitrile - >98.0%(GC), high purity , CAS No.5922-60-1

1 Citations

COA

Grade & Purity:

≥98%(GC)

Cas Number: 5922-60-1
Molecular Weight: 152.58
MDL number: MFCD00017106
PubChem CID: 80019
PubChem SID: 488185805

In stock

Item Number

A151558

Grouped product items
SKU	Size	Availability	Price
A151558-1g	1g	3	$10.90
A151558-5g	5g	3	$41.90
A151558-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$75.90
A151558-25g	25g	2	$152.90
A151558-100g	100g	1	$550.90
A151558-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$2,477.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	AC-15771 \| 3-(2-chloro-phenyl)-propionic acid \| AM20050119 \| GEO-00097 \| 2-Cyano-4-chloroaniline \| STK802208 \| AP-685/40847984 \| S12320 \| SB75818 \| BP-20123 \| EINECS 227-651-5 \| W-105336 \| 2-Amino-5-chlorobenzonitrile, 98% \| Q27279347 \| Z991549028 \| SCHEM
Specifications & Purity	≥98%(GC)
Shipped In	Normal
Product Description	The vibrational spectra of 2-amino-5-chlorobenzonitrile was studied using density functinal theory. 2-Amino-5-chlorobenzonitrile was used to build up the 2,2-dioxide-1H-2,1,3-benzothiadiazine ring system.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzonitriles
Intermediate Tree Nodes	Not available
Direct Parent	Benzonitriles
Alternative Parents	Aniline and substituted anilines Chlorobenzenes Aryl chlorides Nitriles Primary amines Organopnictogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzonitrile - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carbonitrile - Nitrile - Amine - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
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	488185805
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488185805
IUPAC Name	2-amino-5-chlorobenzonitrile
INCHI	InChI=1S/C7H5ClN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2
InChIKey	QYRDWARBHMCOAG-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1Cl)C#N)N
Isomeric SMILES	C1=CC(=C(C=C1Cl)C#N)N
WGK Germany	3
Molecular Weight	152.58
Reaxy-Rn	2358972
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2358972&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.

9 results found

Lot Number	Certificate Type	Date	Item
A2104220	Certificate of Analysis	Oct 09, 2024	A151558
A2104219	Certificate of Analysis	Oct 09, 2024	A151558
A2104218	Certificate of Analysis	Oct 09, 2024	A151558
A2104217	Certificate of Analysis	Oct 09, 2024	A151558
A2104216	Certificate of Analysis	Oct 09, 2024	A151558
L2426280	Certificate of Analysis	Jun 28, 2024	A151558
A2508020	Certificate of Analysis	Jun 28, 2024	A151558
K2324044	Certificate of Analysis	Dec 05, 2023	A151558
E2320017	Certificate of Analysis	Jun 01, 2023	A151558

Chemical and Physical Properties

Solubility	Soluble in methanol.
Boil Point(°C)	159 °C/10 mmHg
Melt Point(°C)	96 °C
Molecular Weight	152.580 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	152.014 Da
Monoisotopic Mass	152.014 Da
Topological Polar Surface Area	49.800 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	160.000
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	1

Citations of This Product

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