ChemicalBook > CAS DataBase List > 4-(4-Boc-piperazin-1-yl)-3-fluoroaniline

4-(4-Boc-piperazin-1-yl)-3-fluoroaniline

Product Name
4-(4-Boc-piperazin-1-yl)-3-fluoroaniline
CAS No.
154590-35-9
Chemical Name
4-(4-Boc-piperazin-1-yl)-3-fluoroaniline
Synonyms
4-(4-Boc-1-piperazinyl)-3-fluoroaniline;4-(4-Boc-piperazin-1-yl)-3-fluoroaniline;3-Fluoro-4-[4-(Boc-amino)piperidino]aniline;4-(4-Amino-2-fluorophenyl)-1-Boc-piperazine;4-(4-Boc-piperazin-1-yl)-3-fluoroaniline ISO 9001:2015 REACH;4-(4-Amino-2-fluoro-phenyl)-piperazine-1-carboxylic acid tert-butyl ester;1-Piperazinecarboxylic acid, 4-(4-amino-2-fluorophenyl)-, 1,1-dimethylethyl ester
CBNumber
CB21562066
Molecular Formula
C15H22FN3O2
Formula Weight
295.35
MOL File
154590-35-9.mol
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4-(4-Boc-piperazin-1-yl)-3-fluoroaniline Property

Boiling point:
439.6±45.0 °C(Predicted)
Density 
1.198±0.06 g/cm3(Predicted)
storage temp. 
2-8°C(protect from light)
form 
solid
pka
6.67±0.10(Predicted)
Appearance
White to light yellow Solid
InChI
InChI=1S/C15H22FN3O2/c1-15(2,3)21-14(20)19-8-6-18(7-9-19)13-5-4-11(17)10-12(13)16/h4-5,10H,6-9,17H2,1-3H3
InChIKey
IULXQAJBODFBAK-UHFFFAOYSA-N
SMILES
N1(C(OC(C)(C)C)=O)CCN(C2=CC=C(N)C=C2F)CC1
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Safety

HS Code 
2933599590
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

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N-Bromosuccinimide Price

TRC
Product number
B809878
Product name
tert-Butyl4-(4-Amino-2-fluorophenyl)piperazine-1-carboxylate
Packaging
50mg
Price
$60
Updated
2021/12/16
AK Scientific
Product number
W3370
Product name
4-(4-Boc-piperazin-1-yl)-3-fluoroaniline
Packaging
250mg
Price
$82
Updated
2021/12/16
Matrix Scientific
Product number
046131
Product name
tert-Butyl 4-(4-amino-2-fluorophenyl)tetrahydro-1(2H)-pyrazinecarboxylate
Purity
95%
Packaging
1g
Price
$49
Updated
2021/12/16
Apolloscientific
Product number
PC8788
Product name
4-(4-Amino-2-fluorophenyl)piperazine,N1-BOCprotected
Packaging
250mg
Price
$13
Updated
2021/12/16
Matrix Scientific
Product number
046131
Product name
tert-Butyl 4-(4-amino-2-fluorophenyl)tetrahydro-1(2H)-pyrazinecarboxylate
Purity
95%
Packaging
500mg
Price
$32
Updated
2021/12/16
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4-(4-Boc-piperazin-1-yl)-3-fluoroaniline Chemical Properties,Usage,Production

Synthesis

154590-34-8

154590-35-9

Preparation of 3-4-2: [3-Fluoro-4-(Boc-piperazinyl)]aniline To 150 mL of ethyl acetate were sequentially added 9.3 g (28.6 mmol) of tert-butyl 4-(2-fluoro-4-nitrophenyl)piperazine-1-carboxylate synthesized by the preparation of Example 3-4-1 and 930 mg (10 wt%) of Pd/C catalyst. The mixture was placed in a hydrogen reactor and reacted at 4 bar hydrogen pressure for 6 hours. Upon completion of the reaction, the Pd/C catalyst was removed by filtration. The filtrate was concentrated by distillation under reduced pressure and subsequently dried under vacuum at about 40 °C to give 8.22 g (yield: 97%) of the title compound. Mass spectrum (M + H)+: 296.11 1H-NMR (DMSO-d6) δ: 1.42 (s, 9H), 2.76 (br m, 4H), 3.43 (br m, 4H), 5.02 (s, 2H), 6.33 (m, 2H), 6.79 (m, 1H).

References

[1] Patent: US2011/306606, 2011, A1. Location in patent: Page/Page column 15
[2] Patent: EP2394993, 2011, A2. Location in patent: Page/Page column 23
[3] Patent: WO2005/82892, 2005, A2. Location in patent: Page/Page column 62-63
[4] Patent: WO2004/18439, 2004, A1. Location in patent: Page 31
[5] Patent: US2007/100141, 2007, A1. Location in patent: Page/Page column 27

4-(4-Boc-piperazin-1-yl)-3-fluoroaniline Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 4-(4-Boc-piperazin-1-yl)-3-fluoroaniline manufacturers

Shaanxi Dideu Medichem Co. Ltd
Product
4-(4-Boc-piperazin-1-yl)-3-fluoroaniline 154590-35-9
Price
US $0.00-0.00/KG
Min. Order
10mg
Purity
99%HPLC
Supply Ability
2000tons
Release date
2020-01-17

154590-35-9, 4-(4-Boc-piperazin-1-yl)-3-fluoroanilineRelated Search:


  • 4-(4-Boc-piperazin-1-yl)-3-fluoroaniline
  • 4-(4-Amino-2-fluoro-phenyl)-piperazine-1-carboxylic acid tert-butyl ester
  • 4-(4-Amino-2-fluorophenyl)-1-Boc-piperazine
  • 3-Fluoro-4-[4-(Boc-amino)piperidino]aniline
  • 1-Piperazinecarboxylic acid, 4-(4-amino-2-fluorophenyl)-, 1,1-dimethylethyl ester
  • 4-(4-Boc-piperazin-1-yl)-3-fluoroaniline ISO 9001:2015 REACH
  • 4-(4-Boc-1-piperazinyl)-3-fluoroaniline
  • 154590-35-9
  • C15H20FN2No2O2