Home Amines 71601-35-9
71601-35-9,MFCD00181241
Catalog No.:AA019P18

71601-35-9 | 4-[Bis(2-chloroethyl)amino]benzonitrile

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100mg
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250mg
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA019P18
Chemical Name:
4-[Bis(2-chloroethyl)amino]benzonitrile
CAS Number:
71601-35-9
Molecular Formula:
C11H12Cl2N2
Molecular Weight:
243.1324
MDL Number:
MFCD00181241
SMILES:
ClCCN(c1ccc(cc1)C#N)CCCl
NSC Number:
294982
Properties
Computed Properties
 
Complexity:
210  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
5  
XLogP3:
2.6  

Downstream Synthesis Route

[1],1957,vol.6,p.185    Chem.Abstr.,1960,p.5550

[1],1957,vol.6,p.185,191    Chem.Abstr.,1960,p.5550

[1],1957,vol.6,p.185,191    Chem.Abstr.,1960,p.5550

64-17-5    71601-35-9   
4-Bis-(2-chloro-ethyl)-amino-benzimidicacidethylester;hydrochloride 

[1]JournalofMedicinalChemistry,1994,vol.37,p.4338-4345

71601-35-9   
2-<2-<4-(N,N-bis(2-chloroethyl)amino)phenyl>-6-benzimidazolyl>-6-(1-methyl-4-piperazinyl)benzimidazoletrihydrochloride 

[1]JournalofMedicinalChemistry,1994,vol.37,p.4338-4345

Literature
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Tags:71601-35-9 Molecular Formula|71601-35-9 MDL|71601-35-9 SMILES|71601-35-9 4-[Bis(2-chloroethyl)amino]benzonitrile