O-(2,4-dinitrophenyl)hydroxylamine - ≥97% , CAS No.17508-17-7

CAS: 17508-17-7 Cat. No.: O174986 Formula: C₆H₅N₃O₅ Peso molecolare: 199.12 Numero EC: 241-512-6

GRADE & PURITY ≥97%

Synonyms

1-(aminooxy)-2,4-dinitrobenzene | 1-Aminooxy-2,4-dinitrobenzene | MFCD00955996 | SCHEMBL123957 | YLACRFYIUQZNIV-UHFFFAOYSA-N | SB40752 | 1H-Pyrazole-5-carboxylic acid, 1-methyl-4-nitro- | Ethanone, 1-(2-fluoro-4-methoxyphenyl)- | AKOS006275705 | MFCD00075

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

1-(aminooxy)-2,4-dinitrobenzene | 1-Aminooxy-2,4-dinitrobenzene | MFCD00955996 | SCHEMBL123957 | YLACRFYIUQZNIV-UHFFFAOYSA-N | SB40752 | 1H-Pyrazole-5-carboxylic acid, 1-methyl-4-nitro- | Ethanone, 1-(2-fluoro-4-methoxyphenyl)- | AKOS006275705 | MFCD00075

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥97%

Nomi e identificatori

• Pubchem Sid: 488186397
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186397
• Sorrisi canonici: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])ON
• IUPAC Name: O-(2,4-dinitrophenyl)hydroxylamine
• InChIKey: YLACRFYIUQZNIV-UHFFFAOYSA-N
• INCHI: 1S/C6H5N3O5/c7-14-6-2-1-4(8(10)11)3-5(6)9(12)13/h1-3H,7H2
• Isomeri SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])ON
• Peso molecolare: 199.12
• Reaxy-Rn: 656517
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=656517&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Nitrobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Nitrobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitrobenzenes
• Alternative Parents: Phenoxy compounds O-phenylhydroxylamines Nitroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Nitrobenzene - Phenoxy compound - O-phenylhydroxylamine - 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 - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Descrizione: 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

Data sources

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

Proprietà chimiche e fisiche

• Sensibilità: Air Sensitive,Heat Sensitive
• Punto di fusione (°C): 107 °C
• Peso molecolare: 199.120 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 199.023 Da
• Monoisotopic Mass: 199.023 Da
• Topological Polar Surface Area: 127.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 235.000
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 17508-17-7, the molecular formula is C6H5N3O5, and the molecular weight is 199.12 g/mol. InChIKey YLACRFYIUQZNIV-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.