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55096-88-3,MFCD00716882
Catalog No.:AA00D96J

55096-88-3 | Benzyl-(4-fluorobenzyl)amine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
in stock  
$546.00   $382.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00D96J
Chemical Name:
Benzyl-(4-fluorobenzyl)amine
CAS Number:
55096-88-3
Molecular Formula:
C14H15ClFN
Molecular Weight:
251.7270
MDL Number:
MFCD00716882
SMILES:
Fc1ccc(cc1)CNCc1ccccc1.Cl
Properties
Properties
 
BP:
309.5°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
181  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Hoffmann;Stenberg;Ljunggren;Svensson;Nilsson[JournalofMedicinalChemistry,1975,vol.18,#3,p.278-284]

[1]Hoffmann;Stenberg;Ljunggren;Svensson;Nilsson[JournalofMedicinalChemistry,1975,vol.18,#3,p.278-284]

[1]Poling,StephenM.;Hsu,Wan-Jean;Yokoyama,Henry[Phytochemistry,1980,vol.19,p.1677-1680]

55096-88-3    530-62-1    500221-64-7   
4-amino-<i>N</i>-{5-3-benzyl-3-(4-fluoro-benzyl)-ureido-1-hydroxymethyl-pentyl}-<i>N</i>-isobutyl-benzenesulfonamide 

[1]Stranix,BrentR.;Sauve,Gilles;Bouzide,Abderrahim;Cote,Alexandre;Sevigny,Guy;Yelle,Jocelyn;Perron,Valerie[BioorganicandMedicinalChemistryLetters,2004,vol.14,#15,p.3971-3974]

55096-88-3   
N1-Benzyl-N1-(4-fluoro-benzyl)-pentane-1,5-diamine 

[1]Hoffmann;Stenberg;Ljunggren;Svensson;Nilsson[JournalofMedicinalChemistry,1975,vol.18,#3,p.278-284]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:55096-88-3 Molecular Formula|55096-88-3 MDL|55096-88-3 SMILES|55096-88-3 Benzyl-(4-fluorobenzyl)amine
Catalog No.: AA00D96J
55096-88-3,MFCD00716882
55096-88-3 | Benzyl-(4-fluorobenzyl)amine
Pack Size： 1g
Purity：
in stock
$546.00 $382.00
Quantity
- +
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Technical Information
Catalog Number: AA00D96J
Chemical Name: Benzyl-(4-fluorobenzyl)amine
CAS Number: 55096-88-3
Molecular Formula: C14H15ClFN
Molecular Weight: 251.7270
MDL Number: MFCD00716882
SMILES: Fc1ccc(cc1)CNCc1ccccc1.Cl
Properties
BP: 309.5°C at 760 mmHg  
Storage: Keep in dry area;2-8℃;  
Complexity: 181  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.8  
Downstream Synthesis Route
6280-87-1    55096-88-3    55097-03-5 

[1]Hoffmann;Stenberg;Ljunggren;Svensson;Nilsson[JournalofMedicinalChemistry,1975,vol.18,#3,p.278-284]

459-46-1    100-46-9    55096-88-3 

[1]Hoffmann;Stenberg;Ljunggren;Svensson;Nilsson[JournalofMedicinalChemistry,1975,vol.18,#3,p.278-284]

100-46-9    352-11-4    55096-88-3 

[1]Poling,StephenM.;Hsu,Wan-Jean;Yokoyama,Henry[Phytochemistry,1980,vol.19,p.1677-1680]

55096-88-3    530-62-1    500221-64-7   
4-amino-<i>N</i>-{5-3-benzyl-3-(4-fluoro-benzyl)-ureido-1-hydroxymethyl-pentyl}-<i>N</i>-isobutyl-benzenesulfonamide 

[1]Stranix,BrentR.;Sauve,Gilles;Bouzide,Abderrahim;Cote,Alexandre;Sevigny,Guy;Yelle,Jocelyn;Perron,Valerie[BioorganicandMedicinalChemistryLetters,2004,vol.14,#15,p.3971-3974]

55096-88-3   
N1-Benzyl-N1-(4-fluoro-benzyl)-pentane-1,5-diamine 

[1]Hoffmann;Stenberg;Ljunggren;Svensson;Nilsson[JournalofMedicinalChemistry,1975,vol.18,#3,p.278-284]

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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