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45964-97-4,MFCD00599980
Catalog No.:AA00DD3B

45964-97-4 | 1-(4-Chlorophenyl)guanidine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$145.00   $102.00
- +
1g
98%
in stock  
$311.00   $218.00
- +
5g
98%
in stock  
$909.00   $637.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DD3B
Chemical Name:
1-(4-Chlorophenyl)guanidine
CAS Number:
45964-97-4
Molecular Formula:
C7H8ClN3
Molecular Weight:
169.6115
MDL Number:
MFCD00599980
SMILES:
NC(=N)Nc1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
146  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1  

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1949,p.2561,2568

[1]JournaloftheChemicalSociety,1948,p.586,590

[1]JournaloftheChemicalSociety,1949,p.2561,2568

[1]Patent:DE172979,    Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.8,p.1104

45964-97-4    4637-24-5    21599-35-9   
N-(4-chlorophenyl)-8-(methylthio)-5,6-dihydropyrimido4,5-fquinazolin-2-amine 

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,p.3385-3390

Literature

Title: 4-Chloro-anilinium 4-methyl-benzene-sulfonate.

Journal: Acta crystallographica. Section E, Structure reports online 20111201

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: 4-Chloro-anilinium (4-chloro-phen-yl)guanidinium dichloride hemihydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20100401

Title: Selective urokinase-type plasminogen activator (uPA) inhibitors. Part 1: 2-Pyridinylguanidines.

Journal: Bioorganic & medicinal chemistry letters 20020121

Title: The binding of arylguanidines at 5-HT(3) serotonin receptors: a structure-affinity investigation.

Journal: Bioorganic & medicinal chemistry letters 20010618

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SDS
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