179873-45-1,MFCD07772795
Catalog No.:AA002789

179873-45-1 | N-[4-(1H-Imidazol-1-yl)benzyl]-n-methylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$95.00   $67.00
- +
1g
95%
in stock  
$139.00   $97.00
- +
5g
95%
in stock  
$544.00   $381.00
- +
10g
95%
in stock  
$909.00   $637.00
- +
25g
95%
in stock  
$1,808.00 $1,266.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002789
Chemical Name:
N-[4-(1H-Imidazol-1-yl)benzyl]-n-methylamine
CAS Number:
179873-45-1
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD07772795
SMILES:
CNCc1ccc(cc1)n1ccnc1
Properties
Properties
 
BP:
327.4°C at 760 mmHg  
Form:
Solid  
MP:
67 °C  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1  

Downstream Synthesis Route
(1-benzyl-1H-benzoimidazole-carbonyl)-amino-aceticacid 
  179873-45-1   
1-benzyl-N-(2-4-(1H-imidazol-1-yl)benzyl(methyl)amino}-2-oxoethyl)-1H-benzimidazole-2-carboxamide 

[1]Locationinpatent:schemeortableGuo,Qin;Chandrasekhar,Jayaraman;Ihle,David;Wustrow,DavidJ.;Chenard,BertrandL.;Krause,JamesE.;Hutchison,Alan;Alderman,Dawn;Cheng,Charles;Cortright,Daniel;Broom,Daniel;Kershaw,MarkT.;Simmermacher-Mayer,Jean;Peng,Yao;Hodgetts,KevinJ.[BioorganicandMedicinalChemistryLetters,2008,vol.18,#18,p.5027-5031]

179873-45-1   
C19H21N3O5S 
  1211569-97-9 

[1]CurrentPatentAssignee:EVOTECAG-WO2010/20556,2010,A1Locationinpatent:Page/Pagecolumn81

Literature
Quotation Request
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Additional Info:
SDS
Tags:179873-45-1 Molecular Formula|179873-45-1 MDL|179873-45-1 SMILES|179873-45-1 N-[4-(1H-Imidazol-1-yl)benzyl]-n-methylamine
Catalog No.: AA002789
179873-45-1,MFCD07772795
179873-45-1 | N-[4-(1H-Imidazol-1-yl)benzyl]-n-methylamine
Pack Size: 250mg
Purity: 95%
in stock
$95.00 $67.00
Pack Size: 1g
Purity: 95%
in stock
$139.00 $97.00
Pack Size: 5g
Purity: 95%
in stock
$544.00 $381.00
Pack Size: 10g
Purity: 95%
in stock
$909.00 $637.00
Pack Size: 25g
Purity: 95%
in stock
$1,808.00 $1,266.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002789
Chemical Name: N-[4-(1H-Imidazol-1-yl)benzyl]-n-methylamine
CAS Number: 179873-45-1
Molecular Formula: C11H13N3
Molecular Weight: 187.2410
MDL Number: MFCD07772795
SMILES: CNCc1ccc(cc1)n1ccnc1
Properties
BP: 327.4°C at 760 mmHg  
Form: Solid  
MP: 67 °C  
Storage: Inert atmosphere;2-8℃;  
Complexity: 164  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 3  
XLogP3: 1  
Downstream Synthesis Route
(1-benzyl-1H-benzoimidazole-carbonyl)-amino-aceticacid 
  179873-45-1   
1-benzyl-N-(2-4-(1H-imidazol-1-yl)benzyl(methyl)amino}-2-oxoethyl)-1H-benzimidazole-2-carboxamide 

[1]Locationinpatent:schemeortableGuo,Qin;Chandrasekhar,Jayaraman;Ihle,David;Wustrow,DavidJ.;Chenard,BertrandL.;Krause,JamesE.;Hutchison,Alan;Alderman,Dawn;Cheng,Charles;Cortright,Daniel;Broom,Daniel;Kershaw,MarkT.;Simmermacher-Mayer,Jean;Peng,Yao;Hodgetts,KevinJ.[BioorganicandMedicinalChemistryLetters,2008,vol.18,#18,p.5027-5031]

179873-45-1   
C19H21N3O5S 
  1211569-97-9 

[1]CurrentPatentAssignee:EVOTECAG-WO2010/20556,2010,A1Locationinpatent:Page/Pagecolumn81

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