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

CAS: 613-12-7 Cat. No.: M306004 분자식: C₁₅H₁₂ 분자량: 192.26 EC 번호: 210-329-3

등급 & 순도 ≥97%

Synonyms

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

Storage

Room temperature

Shipped In

Normal

개요

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.

사양

동의어

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

사양 및 순도

≥97%

보관 조건

Room temperature

배송

Normal

순수함

≥97%

이름과 식별자

Pubchem Sid

24896783

정식 스마일

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

이성체 SMILES

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

분자량

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
    • 분류 Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: 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
• 설명: 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

작용 메커니즘

화학 및 물리적 특성

• 분자량: 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