Phenol solution - analytical standard, 1.0mg/ml in methanol , CAS No.108-95-2

CAS: 108-95-2 Cat. No.: P100768 Formule: C₆H₆O Poids moléculaire: 94.11 Beilstein Registry Number: 969616 Numéro CE: 203-632-7

GRADE & PURITY Analytical standard, 1.0mg/ml in methanol

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice,FedEx DG Service

Vue d’ensemble

Phenol belongs to the class of aromatic volatile organic compounds (VOCs).
Application
Phenol may be used as an analytical reference standard for the determination of phenol in:
Air samples from swine and dairy barns by thermal desorption (TD) module coupled with multidimensional gas chromatography (MDGC)-mass spectrometry (MS)/olfactometry (O).
Exhaled breath samples from tobacco cigarette and electronic cigarette smokers by GC-MS.
Bovine breath samples by solid-phase microextraction (SPME) and GC-MS.
Bovine blood samples by headspace in-tube extraction (HS-INTEX) GC-MS.
Industrial and urban air samples by TD-GC-MS.

Specifications

Spécifications et pureté

analytical standard, 1.0mg/ml in methanol

Conditions de stockage de stockage

Store at 2-8°C,Protected from light,Argon charged

Expédié en

Wet ice,FedEx DG Service

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

Grade

Analytical standard

Noms et identifiants

• Sourires canoniques: Oc1ccccc1
• InChIKey: ISWSIDIOOBJBQZ-UHFFFAOYSA-N
• INCHI: 1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
• Isomères SMILES: C1=CC=C(C=C1)O
• WGK Allemagne: 2
• RTECS: SJ3325000
• Numéro ONU: 1671
• Groupe d'emballage: II
• Poids moléculaire: 94.11
• Beilstein: 969616
• Reaxy-Rn: 969616
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=969616&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass 1-hydroxy-4-unsubstituted benzenoids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: 1-hydroxy-4-unsubstituted benzenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-hydroxy-4-unsubstituted benzenoids
• Alternative Parents: 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as 1-hydroxy-4-unsubstituted benzenoids. These are phenols that are unsubstituted at the 4-position.
• External Descriptors: a phenol

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: It is miscible with ethanol, ether, chloroform, and glycerol.
• Sensibilité: Light sensitive.
• Indice de réfraction: 1.54178
• Point d'éclair (°F): 177.8 °F - closed cup
• Point d'éclair (°C): 79.44℃（closed cup）
• Point d'ébullition (°C): 181.7°C
• Point de fusion (°C): 43°C