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104436-60-4,MFCD07368343
Catalog No.:AA007HQN

104436-60-4 | 4-Cyano-2-methoxybenzyl bromide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$86.00   $60.00
- +
250mg
95%
in stock  
$131.00   $92.00
- +
500mg
95%
in stock  
$202.00   $142.00
- +
1g
97%
in stock  
$347.00   $243.00
- +
10g
97%
in stock  
$3,418.00   $2,393.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007HQN
Chemical Name:
4-Cyano-2-methoxybenzyl bromide
CAS Number:
104436-60-4
Molecular Formula:
C9H8BrNO
Molecular Weight:
226.0699
MDL Number:
MFCD07368343
SMILES:
COc1cc(C#N)ccc1CBr
Properties
Computed Properties
 
Complexity:
186  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.2  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

40786-69-4    104436-60-4   
4-(4-Acetyl-3-hydroxy-2-propyl-phenoxymethyl)-3-methoxy-benzonitrile 

[1]JournalofMedicinalChemistry,1989,vol.32,p.811-826

[1]Patent:WO2007/139992,2007,A2.Locationinpatent:Page/Pagecolumn42

[2]Patent:CN107721869,2018,A.Locationinpatent:Paragraph0043;0044;0057;0069;0081

[3]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

[4]BioorganicandMedicinalChemistryLetters,2002,vol.12,p.1203-1208

[5]JournalofMedicinalChemistry,1989,vol.32,p.811-826

[6]Patent:US6455671,2002,B1

[7]Patent:WO2015/161014,2015,A1.Locationinpatent:Page/Pagecolumn177-178

[1]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

[2]Patent:US4997844,1991,A

[1]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

Literature
Quotation Request
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SDS
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Tags:104436-60-4 Molecular Formula|104436-60-4 MDL|104436-60-4 SMILES|104436-60-4 4-Cyano-2-methoxybenzyl bromide
Catalog No.: AA007HQN
104436-60-4,MFCD07368343
104436-60-4 | 4-Cyano-2-methoxybenzyl bromide
Pack Size： 100mg
Purity： 95%
in stock
$86.00 $60.00
Pack Size： 250mg
Purity： 95%
in stock
$131.00 $92.00
Pack Size： 500mg
Purity： 95%
in stock
$202.00 $142.00
Pack Size： 1g
Purity： 97%
in stock
$347.00 $243.00
Pack Size： 10g
Purity： 97%
in stock
$3,418.00 $2,393.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA007HQN
Chemical Name: 4-Cyano-2-methoxybenzyl bromide
CAS Number: 104436-60-4
Molecular Formula: C9H8BrNO
Molecular Weight: 226.0699
MDL Number: MFCD07368343
SMILES: COc1cc(C#N)ccc1CBr
Properties
Complexity: 186  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.2  
Downstream Synthesis Route
4769-96-4    104436-60-4    104436-68-2 

[1]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

40786-69-4    104436-60-4   
4-(4-Acetyl-3-hydroxy-2-propyl-phenoxymethyl)-3-methoxy-benzonitrile 

[1]JournalofMedicinalChemistry,1989,vol.32,p.811-826

3556-60-3    104436-60-4 

[1]Patent:WO2007/139992,2007,A2.Locationinpatent:Page/Pagecolumn42

[2]Patent:CN107721869,2018,A.Locationinpatent:Paragraph0043;0044;0057;0069;0081

[3]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

[4]BioorganicandMedicinalChemistryLetters,2002,vol.12,p.1203-1208

[5]JournalofMedicinalChemistry,1989,vol.32,p.811-826

[6]Patent:US6455671,2002,B1

[7]Patent:WO2015/161014,2015,A1.Locationinpatent:Page/Pagecolumn177-178

104436-77-3    104436-60-4    104436-76-2 

[1]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

[2]Patent:US4997844,1991,A

104436-60-4    104436-58-0    104447-31-6 

[1]JournalofMedicinalChemistry,1990,vol.33,p.2437-2451

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