1-(2-Fluorophenyl)piperazine

Base Information

• Chemical Name: 1-(2-Fluorophenyl)piperazine
• CAS No.: 1011-15-0
• Molecular Formula: C10H13FN2
• Molecular Weight: 180.225
• Hs Code.: 29349990
• European Community (EC) Number: 213-780-4
• DSSTox Substance ID: DTXSID30143732
• Nikkaji Number: J217.128G
• Wikidata: Q72476297
• ChEMBL ID: CHEMBL9429
• Mol file: 1011-15-0.mol

Synonyms:1-(2-Fluorophenyl)piperazine;1011-15-0;Piperazine, 1-(2-fluorophenyl)-;1-(2-Fluorophenyl)-piperazine;1-(2-Fluoro-phenyl)-piperazine;EINECS 213-780-4;CHEMBL9429;MFCD00040726;oFPP;2-fluorophenylpiperazine;2-Fluorophenyl piperazine;4-(fluorophenyl)piperazine;ortho-fluorophenylpiperazine;D08YJP;1-(2-flurophenyl)piperazine;(2-fluoro-phenyl)-piperazine;4-(2-Fluorophenyl)piperazine;BIDD:GT0234;SCHEMBL234734;l-(2-fluorophenyl)-piperazine;1-(2-fluorophenyl) piperazine;DTXSID30143732;AMY23149;BDBM50017457;STK397246;1-(2-Fluorophenyl)piperazine, 97%;AKOS000101160;AC-7147;BH-0401;CS-0034837;F0728;FT-0605539;EN300-19576;Z-L-LEUCINE-BETA-NAPHTHYLAMIDEMONOHYDRATE;AK-968/13034061;J-000325;F2190-0348

Chemical Property of 1-(2-Fluorophenyl)piperazine

Chemical Property:

• Appearance/Colour: clear colorless to light yellow liquid
• Vapor Pressure: 0.0031mmHg at 25°C
• Melting Point: 44-48℃
• Refractive Index: n20/D 1.556(lit.)
• Boiling Point: 283.8 °C at 760 mmHg
• PKA: 8.78±0.10(Predicted)
• Flash Point: 125.4 °C
• PSA: 15.27000
• Density: 1.112 g/cm³
• LogP: 1.62910
• Sensitive.: Air Sensitive
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 180.10627659
• Heavy Atom Count: 13
• Complexity: 157

Purity/Quality:

99% ^*data from raw suppliers

1-(2-Fluorophenyl)piperazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,Xn,T
• Hazard Codes: Xn,T,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1)C2=CC=CC=C2F
• Uses: 1-(2-Fluorophenyl)piperazine (cas# 1011-15-0) is a compound useful in organic synthesis.

Technology Process of 1-(2-Fluorophenyl)piperazine

There total 8 articles about 1-(2-Fluorophenyl)piperazine 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: 72.0%

tert-butyl 4-(2-fluorophenyl)piperazine-1-carboxylate → 1-(o-fluorophenyl)piperazine (1011-15-0)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 2h;

Reference yield: 70.0%

piperazine (110-85-0) + ortho-difluorobenzene (367-11-3) → 1-(o-fluorophenyl)piperazine (1011-15-0)

Guidance literature:

With potassium carbonate; In 1-methyl-pyrrolidin-2-one; at 250 ℃; for 2h; Microwave irradiation; Sealed tube;

DOI:10.1016/j.jfluchem.2012.12.001

Reference yield: 54.5%

piperazine (110-85-0) + 1-chloro-2-fluorobenzene (348-51-6) → 1-(o-fluorophenyl)piperazine (1011-15-0)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; sodium t-butanolate; ruphos; In 1,4-dioxane; at 100 ℃; for 1h;

DOI:10.3390/molecules26113182

upstream raw materials:

2-Fluoroaniline

bis-(2-chloroethyl)amine hydrochloride

piperazine

o-fluorobromobenzene

Downstream raw materials:

2-{2-[4-(2-fluoro-phenyl)-piperazin-1-yl]-ethyl}-quinoline

1-(2-Fluoro-phenyl)-4-(3-nitro-pyridin-4-yl)-piperazine

1-(3-chloropropyl)-4-(2-fluorophenyl)piperazine

5-{4-(4-ethoxy-phenyl)-1-[4-(2-fluoro-phenyl)-piperazine-1-carbanoyl]-butyl}-2,2-dimethyl-[1,3]dioxolan-4-one

Refernces

• 1、 Patel, Rahul V.,Mistry, Bhupendra,Syed, Riyaz,Rathi, Anuj K.,Lee, Yoo-Jung,Sung, Jung-Suk,Shinf, Han-Seung,Keum, Young-Soo. "Chrysin-piperazine conjugates as antioxidant and anticancer agents". . p. 166 - 177. Retrieved 2016.
• 2、 Lv, Kai,Li, Linhu,Wang, Bo,Liu, Mingliang,Wang, Bin,Shen, Weiyi,Guo, Huiyuan,Lu, Yu. "Design, synthesis and antimycobacterial activity of novel imidazo[1,2-a]pyridine-3-carboxamide derivatives". . p. 117 - 125. Retrieved 2017/06/05.