2-(Hydroxymethyl)anthracene

Base Information

• Chemical Name: 2-(Hydroxymethyl)anthracene
• CAS No.: 22863-82-7
• Molecular Formula: C15H12 O
• Molecular Weight: 208.26
• Hs Code.: 2906299090
• DSSTox Substance ID: DTXSID90360908
• Nikkaji Number: J256.575G
• Wikidata: Q82142935
• ChEMBL ID: CHEMBL4177111
• Mol file: 22863-82-7.mol

Synonyms:2-(Hydroxymethyl)anthracene;Anthracen-2-ylmethanol;22863-82-7;2-Anthracenemethanol;(2-Anthracenyl)methanol;2-hydroxymethylanthracene;SCHEMBL3923568;CHEMBL4177111;DTXSID90360908;XAA86382;MFCD00142932;AKOS015856351;CS-0333536;FT-0608818;H0750;T72115;A934271

Chemical Property of 2-(Hydroxymethyl)anthracene

Chemical Property:

• Vapor Pressure: 6.35E-08mmHg at 25°C
• Melting Point: 221.0 to 227.0 °C
• Refractive Index: 1.729
• Boiling Point: 423.4°C at 760 mmHg
• PKA: 14.36±0.10(Predicted)
• Flash Point: 196.3°C
• PSA: 20.23000
• Density: 1.214g/cm³
• LogP: 3.48530
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 208.088815002
• Heavy Atom Count: 16
• Complexity: 238

Purity/Quality:

98% ^*data from raw suppliers

2-(Hydroxymethyl)anthracene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)CO

Technology Process of 2-(Hydroxymethyl)anthracene

There total 2 articles about 2-(Hydroxymethyl)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:

2-methylanthracene-9,10-dione (84-54-8) → 2-(Hydroxymethyl)anthracene (22863-82-7)

Guidance literature:

Multi-step reaction with 4 steps

1: CrO₃ / acetic acid

2: Zn, NH₄OH

3: H₂SO₄

4: DIBAH / CH₂Cl₂

With chromium(VI) oxide; ammonium hydroxide; sulfuric acid; diisobutylaluminium hydride; zinc; In dichloromethane; acetic acid;

DOI:10.1016/0040-4039(96)00898-2

Reference yield:

2-methylanthracene-9,10-dione (84-54-8) → 2-(Hydroxymethyl)anthracene (22863-82-7)

Guidance literature:

Multi-step reaction with 3 steps

1: zinc; ammonia; copper(ll) sulfate pentahydrate / 48 h / 80 °C

2: selenium(IV) oxide / 5,5-dimethyl-1,3-cyclohexadiene / 48 h / 130 °C

3: sodium tetrahydroborate / ethanol / Reflux

With selenium(IV) oxide; sodium tetrahydroborate; copper(ll) sulfate pentahydrate; ammonia; zinc; In 5,5-dimethyl-1,3-cyclohexadiene; ethanol;

DOI:10.1002/chem.202002648

Reference yield: 70.0%

2-(Hydroxymethyl)anthracene (22863-82-7) → anthraquinone-2-carboxylic acid (117-78-2)

Guidance literature:

With oxygen; In water; acetonitrile; for 0.75h; Irradiation;

DOI:10.1016/j.ejmech.2017.05.063

upstream raw materials:

2-methylanthracene-9,10-dione

Downstream raw materials:

2-(iodomethyl)anthracene

(2-Anthrylmethyl)triphenylphosphonium Bromide

anthraquinone-2-carboxylic acid