(5-Methoxypyridine-2-yl)methanol - ≥98% , CAS No.127978-70-5

CAS: 127978-70-5 Cat. No.: M190450 Formule: C₇H₉NO₂ Poids moléculaire: 139.15

GRADE & PURITY ≥98%

Synonyms

MFCD08235020 | 5-METHOXYPYRIDINE-2-METHANOL | AC-33335 | A889112 | 2-Hydroxymethyl-5-methoxypyridine | 5-METHOXY-2-PYRIDINEMETHANOL | EN300-130819 | SY019580 | FT-0738745 | DS-12304 | AKOS006284254 | YSGIZFIQWAPBLG-UHFFFAOYSA-N | SCHEMBL731990 | (5-Methox

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonymes

MFCD08235020 | 5-METHOXYPYRIDINE-2-METHANOL | AC-33335 | A889112 | 2-Hydroxymethyl-5-methoxypyridine | 5-METHOXY-2-PYRIDINEMETHANOL | EN300-130819 | SY019580 | FT-0738745 | DS-12304 | AKOS006284254 | YSGIZFIQWAPBLG-UHFFFAOYSA-N | SCHEMBL731990 | (5-Methox

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 488197954
• Sourires canoniques: COC1=CN=C(C=C1)CO
• IUPAC Name: (5-methoxypyridin-2-yl)methanol
• InChIKey: YSGIZFIQWAPBLG-UHFFFAOYSA-N
• INCHI: 1S/C7H9NO2/c1-10-7-3-2-6(5-9)8-4-7/h2-4,9H,5H2,1H3
• Isomères SMILES: COC1=CN=C(C=C1)CO
• Poids moléculaire: 139.15
• Reaxy-Rn: 1447832
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1447832&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: Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Primary alcohols Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Pyridine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
• Description: 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

Propriétés chimiques et physiques

• Poids moléculaire: 139.150 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 139.063 Da
• Monoisotopic Mass: 139.063 Da
• Topological Polar Surface Area: 42.400 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 97.600
• 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