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O-4-Nitrobenzylhydroxylamine Hydrochloride - ≥98%, high purity , CAS No.2086-26-2

COA

Grade & Purity:

≥98%

Cas Number: 2086-26-2
Molecular Weight: 204.61
Beilstein Registry Number: 6(2)426
MDL number: MFCD00012954
PubChem CID: 74967

In stock

Item Number

O133067

Grouped product items
SKU	Size	Availability	Price	Qty
O133067-1g	1g	3	$53.90
O133067-5g	5g	3	$186.90

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Functional group compounds (254) Hydroxylamines (13)

Basic Description

Synonyms	o-(4-nitrobenzyl) hydroxylamine hydrochloride \| BDBM50146446 \| O-nitrobenzylhydroxylamine \| 2-Pentyl alcohol \| O-4-NITROBENZYLHYDROXYLAMINE HCL [FOR HPLC LABELING] \| EINECS 218-228-6 \| O-(4-NITROBENZYL)HYDROXYLAMINEHYDROCHLORIDE \| 1-[(aminooxy)methyl]-4-n
Specifications & Purity	≥98%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	A reagent for the preparation of N-(4-nitrobenzyloxy)-amino acids as substrates for an unambiguous N-hydroxypeptide synthesis. A reagent for the preparation of N-(4-nitrobenzyloxy)-amino acids as substrates for an unambiguous N-hydroxypeptide synthesis

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 Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrobenzene - Nitroaromatic compound - 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 nitrogen compound - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - 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

IUPAC Name	O-[(4-nitrophenyl)methyl]hydroxylamine;hydrochloride
INCHI	InChI=1S/C7H8N2O3.ClH/c8-12-5-6-1-3-7(4-2-6)9(10)11;/h1-4H,5,8H2;1H
InChIKey	LKCAFSOYOMFQSL-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1CON)[N+](=O)[O-].Cl
Isomeric SMILES	C1=CC(=CC=C1CON)[N+](=O)[O-].Cl
RTECS	NC4400050
Molecular Weight	204.61
Beilstein	6(2)426
Reaxy-Rn	3709565
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3709565&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.

3 results found

Lot Number	Certificate Type	Date	Item
A2206074	Certificate of Analysis	Oct 13, 2023	O133067
A2205584	Certificate of Analysis	Oct 13, 2023	O133067
C2027092	Certificate of Analysis	Feb 19, 2022	O133067

Chemical and Physical Properties

Sensitivity	Moisture sensitive,air sensitive
Melt Point(°C)	210 °C(dec.)
Molecular Weight	204.610 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	204.03 Da
Monoisotopic Mass	204.03 Da
Topological Polar Surface Area	81.100 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	149.000
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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