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15965-57-8,MFCD10001473
Catalog No.:AA001R7E

15965-57-8 | 2-Chloro-4-methyl-1h-benzo[d]imidazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$17.00   $12.00
- +
250mg
95%
in stock  
$42.00   $29.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001R7E
Chemical Name:
2-Chloro-4-methyl-1h-benzo[d]imidazole
CAS Number:
15965-57-8
Molecular Formula:
C8H7ClN2
Molecular Weight:
166.6076
MDL Number:
MFCD10001473
SMILES:
Clc1nc2c([nH]1)c(C)ccc2
Properties
Properties
 
BP:
339.9±35.0°C at 760 mmHg  
Form:
Solid  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
151  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
XLogP3:
2.8  

Upstream Synthesis Route

[1]Patent:WO2016/73407,2016,A1,.Locationinpatent:Page/Pagecolumn56

[2]JournalofMedicinalChemistry,2016,vol.59,#15,p.7188-7211

[3]Patent:US5273975,1993,A,

[4]BioorganicandMedicinalChemistryLetters,2008,vol.18,#18,p.5010-5014

[5]BioorganicandMedicinalChemistryLetters,2014,vol.24,#4,p.1071-1074

[1]Patent:US2004/29866,2004,A1,.Locationinpatent:Page/Pagecolumn8

[2]Patent:US2003/203893,2003,A1,

[1]JournaloftheAmericanChemicalSociety,2007,vol.129,#28,p.8836-8844

[1]BioorganicandMedicinalChemistryLetters,2014,vol.24,#4,p.1071-1074

[2]JournalofMedicinalChemistry,2016,vol.59,#15,p.7188-7211

Downstream Synthesis Route
100-44-7    15965-57-8   
1-benzyl-2-chloro-7-methylbenzimidazole 
 
1-benzyl-2-chloro-4-methylbenzimidazole 

[1]Tetrahedron,1994,vol.50,p.5535-5554

[2]Tetrahedron,1994,vol.50,p.5535-5554

100-44-7    15965-57-8   
1-benzyl-2-chloro-4-methylbenzimidazole 

[1]Tetrahedron,1994,vol.50,p.5535-5554

532-27-4    15965-57-8   
2-chloro-4-methyl-1-phenacylbenzimidazole 

[1]Tetrahedron,1994,vol.50,p.5535-5554

3587-60-8    15965-57-8   
1-benzyloxymethyl-2-chloro-4-methylbenzimidazole 
 
1-benzyloxymethyl-2-chloro-7-methylbenzimidazole 

[1]Tetrahedron,1994,vol.50,p.5535-5554

107-59-5    15965-57-8   
1-tert-butoxycarbonylmethyl-2-chloro-4-methylbenzimidazole 

[1]Tetrahedron,1994,vol.50,p.5535-5554

Literature

Title: Nonpolar isosteres of damaged DNA bases: effective mimicry of mutagenic properties of 8-oxopurines.

Journal: Journal of the American Chemical Society 20070718

Title: Syntheses and properties of low-polarity shape mimics of 8-oxopurines.

Journal: Nucleic acids symposium series (2004) 20070101

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SDS
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