Home Fluorides 221198-99-8
221198-99-8,MFCD05663793
Catalog No.:AA0033MC

221198-99-8 | 3-Fluoro-4-(4-methylpiperazin-1-yl)aniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$6.00   $4.00
- +
250mg
98%
in stock  
$7.00   $5.00
- +
1g
98%
in stock  
$9.00   $7.00
- +
5g
98%
in stock  
$21.00   $15.00
- +
10g
97%
in stock  
$21.00   $15.00
- +
25g
97%
in stock  
$44.00   $31.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0033MC
Chemical Name:
3-Fluoro-4-(4-methylpiperazin-1-yl)aniline
CAS Number:
221198-99-8
Molecular Formula:
C11H16FN3
Molecular Weight:
209.2632
MDL Number:
MFCD05663793
SMILES:
CN1CCN(CC1)c1ccc(cc1F)N
Properties
Properties
 
Form:
Solid  
MP:
87-89 °C  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
204  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.3  

Upstream Synthesis Route

[1]Patent:US2002/151554,2002,A1,

[2]Patent:WO2014/12360,2014,A1,.Locationinpatent:Paragraph00293

[3]Patent:US2015/87639,2015,A1,.Locationinpatent:Paragraph0550

[4]Patent:TWI607995,2017,B,.Locationinpatent:Page/Pagecolumn128

[5]JournalofMedicinalChemistry,2008,vol.51,#12,p.3507-3525

[6]Patent:WO2014/151871,2014,A2,.Locationinpatent:Page/Pagecolumn51

[7]JournalofMedicinalChemistry,2006,vol.49,#16,p.4981-4991

[8]Patent:WO2005/9443,2005,A1,.Locationinpatent:Page/Pagecolumn53

[9]Patent:EP1130016,2001,A1,

[10]Patent:WO2005/9978,2005,A1,.Locationinpatent:Page56

[11]Patent:WO2005/21551,2005,A1,.Locationinpatent:Page/Pagecolumn60

[12]Patent:WO2005/42518,2005,A2,.Locationinpatent:Page/Pagecolumn56

[13]SyntheticCommunications,2010,vol.40,#6,p.789-798

[14]EuropeanJournalofMedicinalChemistry,2014,vol.75,p.43-56

[1]JournalofMedicinalChemistry,2006,vol.49,#16,p.4981-4991

[2]Patent:WO2014/12360,2014,A1,

[3]EuropeanJournalofMedicinalChemistry,2014,vol.75,p.43-56

[4]Patent:WO2014/151871,2014,A2,

[5]Patent:US2015/87639,2015,A1,

[6]Patent:TWI607995,2017,B,

[1]Patent:WO2014/12360,2014,A1,

[2]EuropeanJournalofMedicinalChemistry,2014,vol.75,p.43-56

[3]Patent:WO2014/151871,2014,A2,

[4]Patent:US2015/87639,2015,A1,

[5]Patent:TWI607995,2017,B,

Downstream Synthesis Route

[1]CurrentPatentAssignee:CHENGDUPIONEERPHARMACEUTICALDEVELOPMENTCOLTD-EP3398598,2018,A1

[1]Patent:CN110229156,2019,A

[1]Patent:CN110407840,2019,A

Literature
Quotation Request
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SDS
Tags:221198-99-8 Molecular Formula|221198-99-8 MDL|221198-99-8 SMILES|221198-99-8 3-Fluoro-4-(4-methylpiperazin-1-yl)aniline