4-Chloro-2-pyridinemethanol - ≥98%(GC) , CAS No.63071-10-3

CAS: 63071-10-3 Cat. No.: C154082 Molecular Weight: 143.57 EC Number: 640-154-1

GRADE & PURITY ≥98%(GC)

Synonyms

2-PYRIDINEMETHANOL, 4-CHLORO- | 4-Chloro-2-pyridinemethanol | A8707 | AM20070274 | PD193816 | STL556275 | MB-5013 | MFCD07437885 | 4-Chloro-2-hydroxymethylpyridine | DTXSID30376780 | J-501390 | (4-chloro-2-pyridinyl)methanol | (4-Chloro-2-pyridinyl) metha

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

2-PYRIDINEMETHANOL, 4-CHLORO- | 4-Chloro-2-pyridinemethanol | A8707 | AM20070274 | PD193816 | STL556275 | MB-5013 | MFCD07437885 | 4-Chloro-2-hydroxymethylpyridine | DTXSID30376780 | J-501390 | (4-chloro-2-pyridinyl)methanol | (4-Chloro-2-pyridinyl) metha

Specifications & Purity

≥98%(GC)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%(GC)

Names and Identifiers

• Canonical Smiles: C1=CN=C(C=C1Cl)CO
• IUPAC Name: (4-chloropyridin-2-yl)methanol
• InChIKey: UEAIOHHGRGSGGJ-UHFFFAOYSA-N
• INCHI: 1S/C6H6ClNO/c7-5-1-2-8-6(3-5)4-9/h1-3,9H,4H2
• Isomeric SMILES: C1=CN=C(C=C1Cl)CO
• WGK Germany: 3
• Molecular Weight: 143.57
• Reaxy-Rn: 2935
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2935&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridines and derivatives
• Alternative Parents: Aryl chlorides Heteroaromatic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl chloride - Aryl halide - Pyridine - Heteroaromatic compound - Azacycle - Alcohol - Hydrocarbon derivative - Aromatic alcohol - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - 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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in Methanol
• Sensitivity: Air sensitive
• Boil Point(°C): 66°C/0.06mmHg
• Melt Point(°C): 43-47℃
• Molecular Weight: 143.570 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 143.014 Da
• Monoisotopic Mass: 143.014 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 89.100
• 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