4-(Chloromethyl)benzyl alcohol

Base Information

• Chemical Name: 4-(Chloromethyl)benzyl alcohol
• CAS No.: 16473-35-1
• Molecular Formula: C8H9ClO
• Molecular Weight: 156.612
• Hs Code.: 2906299090
• European Community (EC) Number: 628-028-4
• DSSTox Substance ID: DTXSID80408409
• Nikkaji Number: J1.458.914G
• Wikidata: Q72453799
• Mol file: 16473-35-1.mol

Synonyms:16473-35-1;4-(Chloromethyl)benzyl alcohol;[4-(chloromethyl)phenyl]methanol;(4-(Chloromethyl)phenyl)methanol;Benzenemethanol, 4-(chloromethyl)-;(4-Chloromethyl-phenyl)-methanol;4-(chloromethyl)benzyl alcohol 99;4-(CHLOROMETHYL)BENZYLALCOHOL;4-Chloromethylbenzyl Alcohol;MFCD03427011;p-hydroxymethylbenzyl chloride;4-Hydroxymethylbenzyl chloride;SCHEMBL505943;4-(Chloromethyl)-benzylalcohol;4-Chloro methyl benzyl alcohol;p-Hydroxymethyl-benzyl chloride;(4-Chloromethylphenyl)-methanol;p-Hydroxymethyl- benzyl chloride;4-(hydroxymethyl)benzyl chloride;AMY6614;DTXSID80408409;4-(Chloromethyl)benzyl alcohol, 99%;AKOS006379353;CS-W000659;4-(CHLOROMETHYL)BENZYLALCOHOL99;AC-20726;AS-10607;BP-12077;4-(CHLOROMETHYL)BENZYL ALCOHOL 99;FT-0716501;EN300-124584;F31378;A810589;J-010164

Chemical Property of 4-(Chloromethyl)benzyl alcohol

Chemical Property:

• Appearance/Colour: white powder
• Vapor Pressure: 0.0024mmHg at 25°C
• Melting Point: 58-60 °C(lit.)
• Refractive Index: 1.562
• Boiling Point: 275.9 °C at 760 mmHg
• PKA: 14.27±0.10(Predicted)
• Flash Point: 123.2 °C
• PSA: 20.23000
• Density: 1.195 g/cm³
• LogP: 1.91770
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 156.0341926
• Heavy Atom Count: 10
• Complexity: 87.3

Purity/Quality:

97% ^*data from raw suppliers

(4-(Chloromethyl)phenyl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=CC=C1CO)CCl
• Uses: 4-(Chloromethyl)benzyl alcohol may be used in the synthesis of 4-(chloromethyl)benzyl acetate.

Technology Process of 4-(Chloromethyl)benzyl alcohol

There total 5 articles about 4-(Chloromethyl)benzyl alcohol 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: 98.0%

p-methyloxycarbonylbenzyl chloride (34040-64-7) → 4-(hydroxymethyl)benzyl chloride (16473-35-1)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 20 ℃; for 2h;

DOI:10.1016/j.bmcl.2007.04.024

Reference yield: 96.0%

p-(chloromethyl)benzoic acid (1642-81-5) → 4-(hydroxymethyl)benzyl chloride (16473-35-1)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 20 ℃;

Reference yield: 94.0%

p-xylylene glycol (589-29-7) → 4-(hydroxymethyl)benzyl chloride (16473-35-1)

Guidance literature:

With hydrogenchloride;

DOI:10.1016/j.tet.2013.05.042

upstream raw materials:

p-xylylene glycol

p-methyloxycarbonylbenzyl chloride

p-(chloromethyl)benzoic acid

p-(chloromethyl)benzoyl chloride

Downstream raw materials:

5-amino-6-(2,3-dichlorophenyl)-2,3-dihydro-3-imino-2-(4-hydroxymethyl)phenylmethyl-1,2,4-triazine

4-(chloromethyl)benzyl 2,3,4-tri-O-benzoyl-6-O-triisopropylsilyl-β-D-glucopyranoside

1-Chloromethyl-4-fluoromethylbenzene

[4-[[ethyl(propyl)amino]methyl]phenyl]methanol

Refernces

• 1、 Gao, Lipeng,Gao, Liefang,Fan, Mingxue,Li, Qilong,Jin, Jiyu,Wang, Jing,Lu, Weiyue,Yu, Lei,Yan, Zhiqiang,Wang, Yiting. "Hydrotropic polymer-based paclitaxel-loaded self-assembled nanoparticles: Preparation and biological evaluation". . p. 33248 - 33256. Retrieved 2017.
• 2、 Amberchan, Gabriella,Snelling, Rachel A.,Moya, Enrique,Landi, Madison,Lutz, Kyle,Gatihi, Roxanne,Singaram, Bakthan. "Reaction of Diisobutylaluminum Borohydride, a Binary Hydride, with Selected Organic Compounds Containing Representative Functional Groups". supporting information. p. 6207 - 6227. Retrieved 2021/05/06.