2-(Chloromethyl)phenyl acetate

Base Information

• Chemical Name: 2-(Chloromethyl)phenyl acetate
• CAS No.: 15068-08-3
• Molecular Formula: C9H9ClO2
• Molecular Weight: 184.62
• Hs Code.: 2915390090
• European Community (EC) Number: 626-858-1
• DSSTox Substance ID: DTXSID10402197
• Wikidata: Q82205572
• Mol file: 15068-08-3.mol

Synonyms:2-(Chloromethyl)phenyl acetate;15068-08-3;[2-(chloromethyl)phenyl] Acetate;acetylsalicyl chloride;SCHEMBL248688;DTXSID10402197;ZVARSKBWVMXPQO-UHFFFAOYSA-N;2-(Chloromethyl)phenyl acetate, 97%;AKOS015910657;acetic acid 2-chloromethyl-phenyl ester;FT-0722054;PHENOL,2-(CHLOROMETHYL)-, 1-ACETATE;J-008730

Chemical Property of 2-(Chloromethyl)phenyl acetate

Chemical Property:

• Vapor Pressure: 0.00508mmHg at 25°C
• Melting Point: 32-37 °C(lit.)
• Refractive Index: n20/D 1.523(lit.)
• Boiling Point: 275.5 °C at 760 mmHg
• Flash Point: 134.4 °C
• PSA: 26.30000
• Density: 1.192 g/cm³
• LogP: 2.35070
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 184.0291072
• Heavy Atom Count: 12
• Complexity: 159

Purity/Quality:

99% ^*data from raw suppliers

2-(Chloromethyl)phenylAcetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xn
• Statements: 22-38-41-43
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC=CC=C1CCl

Technology Process of 2-(Chloromethyl)phenyl acetate

There total 3 articles about 2-(Chloromethyl)phenyl acetate 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:

salicylic alcohol (90-01-7) + acetyl chloride (75-36-5) → o-chloromethylphenyl acetate (15068-08-3)

Guidance literature:

Reference yield:

acetic acid-2-hydroxymethylphenyl ester (146952-30-9) → o-chloromethylphenyl acetate (15068-08-3)

Guidance literature:

With thionyl chloride; N,N-diethylaniline; nachf. Erhitzen auf 110-120grad;

Reference yield:

→ o-chloromethylphenyl acetate (15068-08-3)

Guidance literature:

Saligenin, Acetylchlorid;

upstream raw materials:

acetic acid-2-hydroxymethylphenyl ester

salicylic alcohol

acetyl chloride

Downstream raw materials:

N,N'-bis(2-acetoxybenzyl)-4,13-diaza-18-crown-6

2-(2-Acetoxy-benzyl)-2-benzyl-malonic acid diethyl ester

7,16-Bis(2-hydroxyphenylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane

1-acetoxy-2-(1-phenyl-1H-tetrazol-5-ylsulfanylmethyl)-benzene

Refernces