9-Methylanthracene - ≥98% , CAS No.779-02-2

CAS: 779-02-2 Cat. No.: M573197 Summenformel: C₁₅H₁₂ Molekulargewicht: 192.26 Beilstein Registry Number: 1907463 EG-Nummer: 212-299-7

QUALITÄT & REINHEIT ≥98%

Synonyms

CCRIS 2740 | 65NK4CIN03 | BBL103720 | NSC 400540 | UNII-65NK4CIN03 | EINECS 212-299-7 | MFCD00001261 | 9-methyl-anthracene | DTXSID3061134 | 9-methyl anthracene | NSC-400540 | WLN: L C666J B1 | CHEMBL1797294

Storage

Protected from light,Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

CCRIS 2740 | 65NK4CIN03 | BBL103720 | NSC 400540 | UNII-65NK4CIN03 | EINECS 212-299-7 | MFCD00001261 | 9-methyl-anthracene | DTXSID3061134 | 9-methyl anthracene | NSC-400540 | WLN: L C666J B1 | CHEMBL1797294

Spezifikationen & Reinheit

≥98%

Storage

Protected from light,Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

528762955

Kanonisches Lächeln

CC1=C2C=CC=CC2=CC3=CC=CC=C13

IUPAC Name

9-methylanthracene

InChIKey

CPGPAVAKSZHMBP-UHFFFAOYSA-N

INCHI

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

Isomere SMILES

CC1=C2C=CC=CC2=CC3=CC=CC=C13

WGK Deutschland

3

RTECS

CB0700000

UN-Nummer

3077

Molekulargewicht

192.26

Beilstein

1907463

Reaxy-Rn

1907463

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1907463&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: 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
• Beschreibung: 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (0,0003 mg/L at 25°C) and toluene. Slightly soluble in benzene.
• Empfindlichkeit: Sensitive to light
• Siedepunkt (°C): 196-197°C/16mmHg
• Schmelzpunkt (°C): 76-79°C
• Molekulargewicht: 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: 198.000
• 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