5-Methoxypyrimidine - ≥95% , CAS No.31458-33-0

CAS: 31458-33-0 Cat. No.: M303416 Fórmula: C₅H₆N₂O Peso molecular: 110.12

GRAU & PUREZA ≥95%

Synonyms

AC-23096 | SY034303 | A5695 | JIADELSANNMYFC-UHFFFAOYSA-N | 2-fluor-3-methoxy benzoic acid | J-517716 | MFCD04971313 | FT-0671367 | 5-Methoxypyrimidine | Pyrimidine, 5-methoxy- (6CI,7CI,8CI,9CI) | AKOS006295436 | AMY11580 | SCHEMBL168454 | SB57589 | pyrim

Storage

Store at 2-8°C

Shipped In

Wet ice

Visão geral

5-Methoxypyrimidine (cas# 31458-33-0) is a compound useful in organic synthesis.

Especificações

Sinónimos

AC-23096 | SY034303 | A5695 | JIADELSANNMYFC-UHFFFAOYSA-N | 2-fluor-3-methoxy benzoic acid | J-517716 | MFCD04971313 | FT-0671367 | 5-Methoxypyrimidine | Pyrimidine, 5-methoxy- (6CI,7CI,8CI,9CI) | AKOS006295436 | AMY11580 | SCHEMBL168454 | SB57589 | pyrim

Especificações e pureza

≥95%

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥95%

Nomes e identificadores

Pubchem Sid

504759315

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759315

Sorrisos canónicos

COC1=CN=CN=C1

IUPAC Name

5-methoxypyrimidine

InChIKey

JIADELSANNMYFC-UHFFFAOYSA-N

INCHI

1S/C5H6N2O/c1-8-5-2-6-4-7-3-5/h2-4H,1H3

SMILES isoméricas

COC1=CN=CN=C1

Peso molecular

110.12

Reaxy-Rn

109982

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109982&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Pyrimidine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl 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

Propriedades químicas e físicas

• Peso molecular: 110.110 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 110.048 Da
• Monoisotopic Mass: 110.048 Da
• Topological Polar Surface Area: 35.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 61.400
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

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 31458-33-0, the molecular formula is C5H6N2O, and the molecular weight is 110.12 g/mol. InChIKey JIADELSANNMYFC-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.