9,10-Bis(chloromethyl)anthracene

Base Information

• Chemical Name: 9,10-Bis(chloromethyl)anthracene
• CAS No.: 10387-13-0
• Molecular Formula: C16H12Cl2
• Molecular Weight: 275.177
• Hs Code.: 2903999090
• European Community (EC) Number: 677-977-0
• NSC Number: 81650
• UNII: 74QY2YM6ZQ
• DSSTox Substance ID: DTXSID1065059
• Nikkaji Number: J2.273J
• Wikidata: Q72444655
• Mol file: 10387-13-0.mol

Synonyms:9,10-Bis(chloromethyl)anthracene;10387-13-0;9,10-Di(chloromethyl)anthracene;ANTHRACENE, 9,10-BIS(CHLOROMETHYL)-;ICR-450;CCRIS 948;C16H12Cl2;NSC 81650;BRN 2055024;74QY2YM6ZQ;ICR 450;9,10-Bis-chloromethyl-anthracene;NSC-81650;9,10-Bis-(chloromethyl)-anthracene;UNII-74QY2YM6ZQ;NCIOpen2_004345;9,10-dichloromethylanthracene;SCHEMBL187486;DTXSID1065059;UOSROERWQJTVNU-UHFFFAOYSA-;Anthracene,10-bis(chloromethyl)-;C16-H12-Cl2;9,10-Bis-(chloromethyl)anthracene;BCP15398;NSC81650;WLN: L C666J B1G I1G;Bis(chloromethyl)anthracene, 9,10-;MFCD00045388;STK364704;AKOS000508101;AC-5802;CS-W004459;AS-36693;LS-20266;9 pound not10-bis(chloromethyl)anthracene;B1327;FT-0636695;A800833

Chemical Property of 9,10-Bis(chloromethyl)anthracene

Chemical Property:

• Appearance/Colour: yellow crystal
• Vapor Pressure: 3.09E-08mmHg at 25°C
• Melting Point: 258-260 °C
• Refractive Index: 1.69
• Boiling Point: 460.9 °C at 760 mmHg
• Flash Point: 242.4 °C
• PSA: 0.00000
• Density: 1.291 g/cm³
• LogP: 5.47060
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: very faint turbidity in hot Toluene
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 274.0316058
• Heavy Atom Count: 18
• Complexity: 226

Purity/Quality:

99% ^*data from raw suppliers

9,10-Bis(chloromethyl)anthracene ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CCl)CCl

Technology Process of 9,10-Bis(chloromethyl)anthracene

There total 5 articles about 9,10-Bis(chloromethyl)anthracene 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%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + anthracene (120-12-7) → 9,1-bis(chloromethyl)anthracene (10387-13-0)

Guidance literature:

With hydrogenchloride; acetic acid; at 50 ℃; for 24h;

DOI:10.1002/chem.202103285

Reference yield:

9,10-bis(phenoxymethyl)anthracene (166660-39-5) → tetrabenzo[2.2]paracyclophane (5672-97-9) + 9,1-bis(chloromethyl)anthracene (10387-13-0) + 9-(chloromethyl)-10-(phenoxymethyl)anthracene

Guidance literature:

With dichloromethane; Title compound not separated from byproducts; laser-jet photolysis;

DOI:10.1021/ja963643g

Reference yield:

1,3,5-Trioxan (110-88-3) + anthracene (120-12-7) → 9,1-bis(chloromethyl)anthracene (10387-13-0)

Guidance literature:

With hydrogenchloride; cetyltrimethylammonim bromide; acetic acid; In water; at 60 ℃; for 24h; Temperature; Concentration; Reagent/catalyst; Time;

upstream raw materials:

formaldehyd

anthracene

9,10-bis(phenoxymethyl)anthracene

hydrogenchloride

Downstream raw materials:

9,10-bis(phenoxymethyl)anthracene

C₄₆H₃₈N₂O₄S₂

9,10-bis-(((2-(dimethylamino)ethyl)methylamino)methyl)anthracene

9,10-dibromomethylanthracene

Refernces

• 1、 Nathusius, Marvin,Sleeman, Daniel,Pan, Junyou,Rominger, Frank,Freudenberg, Jan,Bunz, Uwe H. F.,Müllen, Klaus. "Kinetic Stabilization of Blue-Emissive Anthracenes: Phenylene Bridging Works Best". supporting information. p. 16606 - 16610. Retrieved 2021/10/16.
• 2、 Zhang, Yan,Jiang, Rui,Jiang, Hongbo,Xia, Qinglian,Wang, Yuting,Xiong, Lulu,Xiang zhou,Hu, Lianzhe,Qi, Wenjing. "Design, synthesis and imaging of a novel mitochondrial fluorescent nanoprobe based on distyreneanthracene-substituted triphenylphosphonium salt". . . Retrieved 2021/11/16.