Fenile propargil etere - ≥97% , CAS No.13610-02-1

CAS: 13610-02-1 Cat. No.: P113824 Formula: C₉H₈O Peso molecolare: 132.16 Beilstein Registry Number: 2040910 Numero EC: 237-095-5

GRADE & PURITY ≥97%

Synonyms

Ether, phenyl 2-propynyl | Phenyl propargyl ether | phenyl-propargylether | phenyl prop-2-yn-1-yl ether | 3,5-Dimethoxy-4-hydroxytoluene | prop-2-ynyloxybenzene | Propargyl phenyl ether | 4(3H)-Pyrimidinone,6-hydroxy-2-phenyl- | Phenyl propargyl ether, te

Storage

Conservare a 2-8°C, con carica di argon

Shipped In

Ghiaccio umido

Specifications

Sinonimi

Ether, phenyl 2-propynyl | Phenyl propargyl ether | phenyl-propargylether | phenyl prop-2-yn-1-yl ether | 3,5-Dimethoxy-4-hydroxytoluene | prop-2-ynyloxybenzene | Propargyl phenyl ether | 4(3H)-Pyrimidinone,6-hydroxy-2-phenyl- | Phenyl propargyl ether, te

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Conservare a 2-8°C, con carica di argon

Spedito in

Ghiaccio umido

Purezza

≥97%

Nomi e identificatori

• Pubchem Sid: 488186191
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186191
• Sorrisi canonici: C#CCOC1=CC=CC=C1
• IUPAC Name: prop-2-ynoxybenzene
• InChIKey: AIQRJSXKXVZCJO-UHFFFAOYSA-N
• INCHI: 1S/C9H8O/c1-2-8-10-9-6-4-3-5-7-9/h1,3-7H,8H2
• Isomeri SMILES: C#CCOC1=CC=CC=C1
• WGK Germania: 3
• Peso molecolare: 132.16
• Beilstein: 2040910
• Reaxy-Rn: 2040910
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2040910&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Alkyl aryl ethers Acetylides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Acetylide - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Air Sensitive,Heat Sensitive
• Indice di rifrazione: 1.533
• Punto di infiammabilità (°F): 76 °C
• Punto di infiammabilità (°C): 76°C
• Punto di ebollizione (°C): 89-90°C
• Peso molecolare: 132.160 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 132.058 Da
• Monoisotopic Mass: 132.058 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 125.000
• 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 13610-02-1, the molecular formula is C9H8O, and the molecular weight is 132.16 g/mol. InChIKey AIQRJSXKXVZCJO-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.