1-Methoxynaphthalene - ≥98% , CAS No.2216-69-5

CAS: 2216-69-5 Cat. No.: M107755 Fórmula: C₁₀H₇OCH₃ Peso molecular: 158.2 Beilstein Registry Number: 774884 Número EC: 218-696-1

GRADE & PURITY ≥98%

Synonyms

1-methoxy naphthalene | 1-Methoxynaphthalene, analytical standard | .alpha.-Methoxynaphthalene | 1-Methoxynaphthalene, >=98% | EINECS 218-696-1 | Naphthalene, 1-methoxy- | 1-Naphthol methyl ether;Naphthalene, 1-methoxy- | alpha-Methoxynaphthalene | 1-Naph

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

1-methoxy naphthalene | 1-Methoxynaphthalene, analytical standard | .alpha.-Methoxynaphthalene | 1-Methoxynaphthalene, >=98% | EINECS 218-696-1 | Naphthalene, 1-methoxy- | 1-Naphthol methyl ether;Naphthalene, 1-methoxy- | alpha-Methoxynaphthalene | 1-Naph

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

488182275

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182275

Sonrisas canónicas

COC1=CC=CC2=CC=CC=C21

IUPAC Name

1-methoxynaphthalene

InChIKey

NQMUGNMMFTYOHK-UHFFFAOYSA-N

INCHI

1S/C11H10O/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3

Isómeros SMILES

COC1=CC=CC2=CC=CC=C21

WGK Alemania

3

RTECS

QJ9465500

Peso molecular

158.2

Beilstein

774884

Reaxy-Rn

774884

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774884&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Anisoles Alkyl aryl ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• 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

Propiedades químicas y físicas

• Solubilidad: Immiscible with water. Miscible with ether, carbon disulfide and benzene.
• Sensibilidad: Air Sensitive
• Índice de refracción: 1.62
• Punto de inflamación (°F): 230 °F
• Punto de inflamación (°C): >110 °C
• Punto de ebullición (°C): 271°C
• Punto de fusión (°C): 6°C
• Peso molecular: 158.200 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 158.073 Da
• Monoisotopic Mass: 158.073 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 144.000
• 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

Preguntas frecuentes

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 under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 2216-69-5, the molecular formula is C11H10O, and the molecular weight is 158.2 g/mol. InChIKey NQMUGNMMFTYOHK-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.