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40389-65-9,MFCD03407501
Catalog No.:AA00C6M9

40389-65-9 | 1-(4-Chlorobenzyl)-1,4-diazepane

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$112.00   $78.00
- +
250mg
97%
in stock  
$211.00   $148.00
- +
1g
97%
in stock  
$477.00   $334.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C6M9
Chemical Name:
1-(4-Chlorobenzyl)-1,4-diazepane
CAS Number:
40389-65-9
Molecular Formula:
C12H17ClN2
Molecular Weight:
224.7298
MDL Number:
MFCD03407501
SMILES:
Clc1ccc(cc1)CN1CCNCCC1
Properties
Computed Properties
 
Complexity:
179  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.1  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2012,vol.22,p.4951-4954

Literature
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Additional Info:
SDS
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Tags:40389-65-9 Molecular Formula|40389-65-9 MDL|40389-65-9 SMILES|40389-65-9 1-(4-Chlorobenzyl)-1,4-diazepane