2-Methoxybenzamidoxime - ≥98% , CAS No.771-28-8

CAS: 771-28-8 Cat. No.: M186532 Summenformel: C₈H₁₀N₂O₂ Molekulargewicht: 166.2 EG-Nummer: 106-417-5

GRADE & PURITY ≥98%

Synonyms

(Z)-N'-HYDROXY-2-METHOXYBENZENECARBOXIMIDAMIDE | DTXSID90998361 | (Z)-N'-hydroxy-2-methoxybenzene-1-carboximidamide | N'-hydroxy-2-methoxybenzenecarboximidamide | BBL005595 | N'-hydroxy-2-methoxybenzene-1-carboximidamide | AKOS000118595 | 1772588-79-0 | N

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

(Z)-N'-HYDROXY-2-METHOXYBENZENECARBOXIMIDAMIDE | DTXSID90998361 | (Z)-N'-hydroxy-2-methoxybenzene-1-carboximidamide | N'-hydroxy-2-methoxybenzenecarboximidamide | BBL005595 | N'-hydroxy-2-methoxybenzene-1-carboximidamide | AKOS000118595 | 1772588-79-0 | N

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln

COC1=CC=CC=C1C(=NO)N

IUPAC Name

N'-hydroxy-2-methoxybenzenecarboximidamide

InChIKey

NFAJEYBUPFIZNQ-UHFFFAOYSA-N

INCHI

1S/C8H10N2O2/c1-12-7-5-3-2-4-6(7)8(9)10-11/h2-5,11H,1H3,(H2,9,10)

Isomere SMILES

COC1=CC=CC=C1/C(=N/O)/N

Molekulargewicht

166.2

Reaxy-Rn

2719158

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2719158&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenol ethers
      • Subclass Anisoles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenol ethers
• Subclass: Anisoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Anisoles
• Alternative Parents: Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Amidoximes Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Methoxybenzene - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Amidoxime - Ether - Amidine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
• 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

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 166.180 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 166.074 Da
• Monoisotopic Mass: 166.074 Da
• Topological Polar Surface Area: 67.800 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 170.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 771-28-8, the molecular formula is C8H10N2O2, and the molecular weight is 166.2 g/mol. InChIKey NFAJEYBUPFIZNQ-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.