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112734-22-2,MFCD00153076
Catalog No.:AA00388O

112734-22-2 | 4-Bromo-2-fluorobenzylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$18.00   $13.00
- +
5g
98%
in stock  
$38.00   $27.00
- +
10g
98%
in stock  
$74.00   $52.00
- +
25g
98%
in stock  
$107.00   $75.00
- +
100g
98%
in stock  
$345.00   $242.00
- +
500g
98%
in stock  
$1,345.00 $942.00
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00388O
Chemical Name:
4-Bromo-2-fluorobenzylamine
CAS Number:
112734-22-2
Molecular Formula:
C7H7BrFN
Molecular Weight:
204.0396
MDL Number:
MFCD00153076
SMILES:
NCc1ccc(cc1F)Br
Properties
Computed Properties
 
Complexity:
110  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.6  

Upstream Synthesis Route

[1]JournalofOrganicChemistry,2008,vol.73,#5,p.1898-1905

[2]JournalofOrganicChemistry,2009,vol.74,#5,p.1964-1970

[3]Patent:WO2017/103611,2017,A1,.Locationinpatent:Paragraph00336

[4]Patent:WO2018/75871,2018,A1,.Locationinpatent:Page/Pagecolumn62

Downstream Synthesis Route
69363-85-5    112734-22-2    503-38-8   
4-3-(4-Bromo-2-fluoro-benzyl)-ureido-thiophene-3-carboxylicacidmethylester 

[1]EuropeanJournalofMedicinalChemistry,1993,vol.28,p.769-781

[1]EuropeanJournalofMedicinalChemistry,1990,vol.25,p.121-126

[1]JournalofMedicinalChemistry,1993,vol.36,p.1176-1187

[1]JournalofMedicinalChemistry,1993,vol.36,p.1176-1187

[1]EuropeanJournalofMedicinalChemistry,1993,vol.28,p.769-781

Literature
Quotation Request
Company Name:
*
Contact Person:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:112734-22-2 Molecular Formula|112734-22-2 MDL|112734-22-2 SMILES|112734-22-2 4-Bromo-2-fluorobenzylamine
Catalog No.: AA00388O
112734-22-2,MFCD00153076
112734-22-2 | 4-Bromo-2-fluorobenzylamine
Pack Size： 1g
Purity： 95%
in stock
$18.00 $13.00
Pack Size： 5g
Purity： 98%
in stock
$38.00 $27.00
Pack Size： 10g
Purity： 98%
in stock
$74.00 $52.00
Pack Size： 25g
Purity： 98%
in stock
$107.00 $75.00
Pack Size： 100g
Purity： 98%
in stock
$345.00 $242.00
Pack Size： 500g
Purity： 98%
in stock
$1,345.00 $942.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00388O
Chemical Name: 4-Bromo-2-fluorobenzylamine
CAS Number: 112734-22-2
Molecular Formula: C7H7BrFN
Molecular Weight: 204.0396
MDL Number: MFCD00153076
SMILES: NCc1ccc(cc1F)Br
Properties
Complexity: 110  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.6  
Upstream Synthesis Route
105942-08-3    112734-22-2 

[1]JournalofOrganicChemistry,2008,vol.73,#5,p.1898-1905

[2]JournalofOrganicChemistry,2009,vol.74,#5,p.1964-1970

[3]Patent:WO2017/103611,2017,A1,.Locationinpatent:Paragraph00336

[4]Patent:WO2018/75871,2018,A1,.Locationinpatent:Page/Pagecolumn62

Downstream Synthesis Route
69363-85-5    112734-22-2    503-38-8   
4-3-(4-Bromo-2-fluoro-benzyl)-ureido-thiophene-3-carboxylicacidmethylester 

[1]EuropeanJournalofMedicinalChemistry,1993,vol.28,p.769-781

118-48-9    112734-22-2    112733-66-1 

[1]EuropeanJournalofMedicinalChemistry,1990,vol.25,p.121-126

21427-62-3    112734-22-2    136122-49-1 

[1]JournalofMedicinalChemistry,1993,vol.36,p.1176-1187

364-74-9    112734-22-2    144727-99-1 

[1]JournalofMedicinalChemistry,1993,vol.36,p.1176-1187

112734-22-2    158461-10-0    158460-92-5 

[1]EuropeanJournalofMedicinalChemistry,1993,vol.28,p.769-781

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