2-Methylanthracene - ≥97% , CAS No.613-12-7

CAS: 613-12-7 Cat. No.: M306004 Formule: C₁₅H₁₂ Poids moléculaire: 192.26 Numéro CE: 210-329-3

QUALITÉ & PURETÉ ≥97%

Synonyms

2-Methylanthracene; NSC 87376|Methylanthracen|Anthracene, methyl-|Anthracene, 2-methyl-|2-METHYLANTHRACENE

Storage

Room temperature

Shipped In

Normal

Vue d’ensemble

2- methyl anthracene, anthracene and dimethyl anthracene are used as raw materials to copolymerize synthetic resin, which can be used as coatings, plastics, fluorescent agents and reagents.

Spécifications

Synonymes

2-Methylanthracene; NSC 87376 | Methylanthracen | Anthracene, methyl- | Anthracene, 2-methyl- | 2-METHYLANTHRACENE

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

Pubchem Sid

24896783

Sourires canoniques

CC1=CC2=CC3=CC=CC=C3C=C2C=C1

IUPAC Name

2-methylanthracene

InChIKey

GYMFBYTZOGMSQJ-UHFFFAOYSA-N

INCHI

1S/C15H12/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-10H,1H3

Isomères SMILES

CC1=CC2=CC3=CC=CC=C3C=C2C=C1

Poids moléculaire

192.26

Reaxy-Rn

2042447

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042447&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Anthracenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenes
• Alternative Parents: Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Anthracene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as anthracenes. These are organic compounds containing a system of three linearly fused benzene rings.
• 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

Mécanismes d'action

Propriétés chimiques et physiques

• Poids moléculaire: 192.250 g/mol
• XLogP3: 5.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 192.094 Da
• Monoisotopic Mass: 192.094 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 220.000
• 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