7-Bromomethyl-12-methylbenz(A)anthracene

Base Information

• Chemical Name: 7-Bromomethyl-12-methylbenz(A)anthracene
• CAS No.: 16238-56-5
• Molecular Formula: C20H15 Br
• Molecular Weight: 335.26
• Hs Code.: 2903999090
• UNII: OB11678893
• DSSTox Substance ID: DTXSID3024651
• Nikkaji Number: J3.137B
• Wikidata: Q27109355
• Metabolomics Workbench ID: 53806
• Mol file: 16238-56-5.mol

Synonyms:7-bromomethyl-12-methylbenz(a)anthracene;7-bromomethyl-12-methylbenzanthracene

Chemical Property of 7-Bromomethyl-12-methylbenz(A)anthracene

Chemical Property:

• Vapor Pressure: 3.98E-10mmHg at 25°C
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 513°C at 760 mmHg
• Flash Point: 258.5°C
• PSA: 0.00000
• Density: 1.411g/cm³
• LogP: 6.34950
• XLogP3: 6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 334.03571
• Heavy Atom Count: 21
• Complexity: 365

Purity/Quality:

99% ^*data from raw suppliers

7-BROMOMETHYL-12-METHYLBENZ(A)ANTHRACENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2C(=C(C3=CC=CC=C13)CBr)C=CC4=CC=CC=C42

Technology Process of 7-Bromomethyl-12-methylbenz(A)anthracene

There total 2 articles about 7-Bromomethyl-12-methylbenz(A)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:

[3H]-7-Hydroxymethyl-12-methylbenz[a]anthracene (568-75-2) → 7-Bromomethyl-12-methylbenzanthracen (16238-56-5)

Guidance literature:

With phosphorus tribromide; In benzene;

DOI:10.1021/jm00311a047

Reference yield:

7-Methoxymethyl-12-methyl-benzanthracen (13345-60-3) → 7-Bromomethyl-12-methylbenzanthracen (16238-56-5)

Guidance literature:

With hydrogen bromide;

DOI:10.1021/jm00271a018

upstream raw materials:

7-Methoxymethyl-12-methyl-benzanthracen

[3H]-7-Hydroxymethyl-12-methylbenz[a]anthracene

Refernces

• 1、 Pataki,Wlos,Cho. "Adrenocorticolytic derivatives of benz[a]anthracene.". . p. 1083 - 1086. Retrieved 2007/10/05.