1,4-Dimethoxyanthracene

Base Information

• Chemical Name: 1,4-Dimethoxyanthracene
• CAS No.: 13076-29-4
• Molecular Formula: C16H14O2
• Molecular Weight: 238.286
• Hs Code.: 29093090
• NSC Number: 106547
• DSSTox Substance ID: DTXSID6065343
• Nikkaji Number: J47.294H
• Wikidata: Q63396120
• ChEMBL ID: CHEMBL223575
• Mol file: 13076-29-4.mol

Synonyms:1,4-Dimethoxyanthracene;13076-29-4;Anthracene, 1,4-dimethoxy-;NSC-106547;MLS002703923;CHEMBL223575;NSC 106547;NSC106547;Anthracene,4-dimethoxy-;D05GWI;SCHEMBL1061836;DTXSID6065343;BDBM50195861;MFCD00051322;SMR001570635;F21391;Q63396120

Chemical Property of 1,4-Dimethoxyanthracene

Chemical Property:

• Appearance/Colour: yellow crystalline powder
• Vapor Pressure: 8.51E-07mmHg at 25°C
• Melting Point: 134.5-136.5 °C
• Refractive Index: 1.653
• Boiling Point: 417.6 °C at 760 mmHg
• Flash Point: 178.9 °C
• PSA: 18.46000
• Density: 1.158 g/cm³
• LogP: 4.01020
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 238.099379685
• Heavy Atom Count: 18
• Complexity: 250

Purity/Quality:

99% ^*data from raw suppliers

1,4-DIMETHOXYANTHRACENE 95.00% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C2=CC3=CC=CC=C3C=C12)OC

Technology Process of 1,4-Dimethoxyanthracene

There total 15 articles about 1,4-Dimethoxyanthracene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 95.0%

1,4-dihydroxy-9,10-anthracenedione (81-64-1,103220-12-8) → 1,4-dimethoxyanthracene (13076-29-4)

Guidance literature:

With hydrogenchloride; sodium borohydrid; In methanol;

Reference yield: 78.0%

1,4-dihydroxyanthracene (7218-35-1) + methyl iodide (74-88-4) → 1,4-dimethoxyanthracene (13076-29-4)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; at 25 ℃; for 1.5h;

DOI:10.1021/jo010958s

Reference yield: 78.0%

→ 1,4-dimethoxyanthracene (13076-29-4)

Guidance literature:

upstream raw materials:

methanol

1,4-dihydroxyanthracene

1,4-dimethoxy-9,10-dihydro-9,10-anthracenediol

dimethyl sulfate

Downstream raw materials:

12-(p-nitrobenzoyl)-1,3-dichloro-7,10-dimethoxy-11,12-dihydro-6,11<1',2'>-benzeno-6H-dibenz<1,4>oxazocine

1,4-dimethoxyanthraquinone

2,5,8-Trimethoxy-9,10-dihydro-9,10-[1,2]benzenoanthracene-1,4-dione

((C₄H₉)3P)2Ni(C₁₄H₈(OCH₃)2)

Refernces

• 1、 Lu, Lingang,Chen, Qiyin,Zhu, Xiaozhang,Chen, Chuanfeng. "A New Convenient Synthesis of Alkoxyanthracenes from Alkoxy-9,10- anthraquinones". . p. 2464 - 2466. Retrieved 2003.
• 2、 Olah, George A.,Singh, Brij P.. "Carbon-13 NMR Spectroscopic Study of Substituted Anthracene Dications". . p. 4830 - 4835. Retrieved 1983.
• 3、 Kitamura, Chitoshi,Hasegawa, Munehiro,Ishikawa, Hiroshi,Fujimoto, Jun,Ouchi, Mikio,Yoneda, Akio. "Synthesis, isolation, and characterization of Diels-Alder adducts between 1,4-dialkoxyanthracenes and maleic anhydride". . p. 1385 - 1393. Retrieved 2007/10/03.