2-[(S)-1-Hydroxyethyl]pyridine - ≥97%(GC)(T) , CAS No.59042-90-9

CAS: 59042-90-9 Cat. No.: S161029 Formule: C₇H₉NO Poids moléculaire: 123.16 Beilstein Registry Number: 21(5)2,204 Numéro CE: 625-667-0 PubChem CID: 11094597

GRADE & PURITY ≥97%(GC)(T)

Synonyms

(S)-1-(pyridin-2-yl)ethan-1-ol | 2-[(S)-1-Hydroxyethyl]pyridine | H1263 | C16040 | (S)-1-(2-Pyridyl)ethanol | (s)-1-(2-pyridyl)-ethanol | SCHEMBL1193974 | (S)-(-)-2-(1-HYDROXYETHYL)PYRIDINE | (1S)-1-(pyridin-2-yl)ethan-1-ol | (S)-1-Pyridin-2-yl-ethanol |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonymes

(S)-1-(pyridin-2-yl)ethan-1-ol | 2-[(S)-1-Hydroxyethyl]pyridine | H1263 | C16040 | (S)-1-(2-Pyridyl)ethanol | (s)-1-(2-pyridyl)-ethanol | SCHEMBL1193974 | (S)-(-)-2-(1-HYDROXYETHYL)PYRIDINE | (1S)-1-(pyridin-2-yl)ethan-1-ol | (S)-1-Pyridin-2-yl-ethanol |

Spécifications et pureté

≥97%(GC)(T)

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

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

Pureté

≥97%(GC)(T)

Noms et identifiants

Pubchem Sid

504765988

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504765988

Sourires canoniques

CC(C1=CC=CC=N1)O

IUPAC Name

(1S)-1-pyridin-2-ylethanol

InChIKey

PPHIIIRFJKDTLG-LURJTMIESA-N

INCHI

1S/C7H9NO/c1-6(9)7-4-2-3-5-8-7/h2-6,9H,1H3/t6-/m0/s1

Isomères SMILES

C[C@@H](C1=CC=CC=N1)O

PubChem CID

11094597

Poids moléculaire

123.16

Beilstein

21(5)2,204

Reaxy-Rn

1524524

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 Secondary alcohols Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine - Heteroaromatic compound - Secondary alcohol - Azacycle - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic 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

Propriétés chimiques et physiques

• Solubilité: Soluble in Toluene
• Sensibilité: Air Sensitive,Heat Sensitive
• Rotation spécifique [α]: -29° (C=1,Toluene)
• Point d'éclair (°C): 81 °C
• Point de fusion (°C): 29°C(lit.)
• Poids moléculaire: 123.150 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• 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: 85.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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