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2-Nitrophenylboronic Acid (contains varying amounts of Anhydride) - 97%, high purity , CAS No.5570-19-4

COA

Grade & Purity:

≥97%

Cas Number: 5570-19-4
Molecular Weight: 166.93
MDL number: MFCD00161358
PubChem CID: 2773548
PubChem SID: 504761833

In stock

Item Number

N133916

Grouped product items
SKU	Size	Availability	Price
N133916-1g	1g	3	$49.90
N133916-5g	5g	3	$170.90
N133916-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$306.90
N133916-25g	25g	3	$688.90
N133916-100g	100g	3	$2,479.90

View related series

arylboronic acid (628) Organoboron (685)

Basic Description

Synonyms	A830763 \| MFCD00161358 \| HY-W002465 \| 2-Nitrophenylboronic acid \| 2-nitrophenyl-boronic acid \| Boronic acid, B-(2-nitrophenyl)- \| nitrooxy(phenyl)borinic acid \| EN300-120491 \| OL10072 \| SCHEMBL14727517 \| O-NITROBENZENEBORONIC ACID \| 2-nitrophenyl boronic
Specifications & Purity	≥97%
Shipped In	Normal
Product Description	Used in a preparation of unsymmetrical 2,2′-dinitrobiphenyls via Suzuki-Miyaura cross-coupling with nitrophenyl halides.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrobenzenes
Alternative Parents	Nitroaromatic compounds Boronic acids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic metalloid salts Organopnictogen compounds Organonitrogen compounds Organoboron compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrobenzene - Nitroaromatic compound - Boronic acid derivative - Boronic acid - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic metalloid salt - Organic nitrogen compound - Organonitrogen compound - Organoboron compound - Organic oxygen compound - Organopnictogen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504761833
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761833
IUPAC Name	(2-nitrophenyl)boronic acid
INCHI	InChI=1S/C6H6BNO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,9-10H
InChIKey	SFUIGUOONHIVLG-UHFFFAOYSA-N
Smiles	B(C1=CC=CC=C1[N+](=O)[O-])(O)O
Isomeric SMILES	B(C1=CC=CC=C1[N+](=O)[O-])(O)O
WGK Germany	3
Molecular Weight	166.93
Reaxy-Rn	3032097
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3032097&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.

7 results found

Lot Number	Certificate Type	Date	Item
L2418067	Certificate of Analysis	Dec 28, 2024	N133916
K2208348	Certificate of Analysis	Aug 22, 2024	N133916
K2208444	Certificate of Analysis	Aug 22, 2024	N133916
K2208591	Certificate of Analysis	Aug 22, 2024	N133916
K1710024	Certificate of Analysis	May 10, 2023	N133916
H1503086	Certificate of Analysis	Mar 08, 2023	N133916
C2209186	Certificate of Analysis	Mar 14, 2022	N133916

Chemical and Physical Properties

Solubility	Soluble in Methanol,Ether,Ethanol
Melt Point(°C)	142°C(lit.)
Molecular Weight	166.930 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	167.039 Da
Monoisotopic Mass	167.039 Da
Topological Polar Surface Area	86.300 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	169.000
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

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