4-(2-Hydroxyethyl)pyridine - ≥98% , CAS No.5344-27-4

CAS: 5344-27-4 Cat. No.: H113413 Formule: C₇H₉NO Poids moléculaire: 123.15 Numéro CE: 226-286-9

GRADE & PURITY ≥98%

Synonyms

DWPYQDGDWBKJQL-UHFFFAOYSA-N | 2-pyridin-4-ylethanol | 2-pyridin-4-yl-ethanol | J-506586 | 2-(4-Pyridyl)ethanol | Hypopresol | UNII-I89RDQ5YD9 | Adenosine sulfatophosphate | EINECS 226-286-9 | SY001138 | MFCD00129038 | 4,5-Dimethoxy-6-(2-propenyl)-1,3-benz

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Vue d’ensemble

4-(2-Hydroxyethyl)pyridine acts as a reagent for the protection of carboxyl groups as their 2-(4-pyridyl)ethyl esters in organic synthesis. Further, it is used as an active pharmaceutical ingredient intermediate.

Specifications

Synonymes

DWPYQDGDWBKJQL-UHFFFAOYSA-N | 2-pyridin-4-ylethanol | 2-pyridin-4-yl-ethanol | J-506586 | 2-(4-Pyridyl)ethanol | Hypopresol | UNII-I89RDQ5YD9 | Adenosine sulfatophosphate | EINECS 226-286-9 | SY001138 | MFCD00129038 | 4,5-Dimethoxy-6-(2-propenyl)-1,3-benz

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Store at -20°C,Argon charged

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Sourires canoniques

C1=CN=CC=C1CCO

IUPAC Name

2-pyridin-4-ylethanol

InChIKey

DWPYQDGDWBKJQL-UHFFFAOYSA-N

INCHI

1S/C7H9NO/c9-6-3-7-1-4-8-5-2-7/h1-2,4-5,9H,3,6H2

Isomères SMILES

C1=CN=CC=C1CCO

WGK Allemagne

2

RTECS

UT2971000

Poids moléculaire

123.15

Reaxy-Rn

111361

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=111361&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridines and derivatives
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as pyridines and derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms.
• 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

Cibles associées (non humaines)

Frankliniella occidentalis (90 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Thrips tabaci (33 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Miscible with water.
• Sensibilité: Hygroscopic.
• Indice de réfraction: 1.538
• Point d'éclair (°F): 92°C
• Point d'éclair (°C): 92°C
• Point d'ébullition (°C): 121-122°C
• Point de fusion (°C): 8-10°C
• Poids moléculaire: 123.150 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 123.068 Da
• Monoisotopic Mass: 123.068 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 69.300
• 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

Foire aux questions

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 ?20 °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 in an insulated container with ice pads. 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 5344-27-4, the molecular formula is C7H9NO, and the molecular weight is 123.15 g/mol. InChIKey DWPYQDGDWBKJQL-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.