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Home Amines 18655-50-0
18655-50-0,MFCD06212968
Catalog No.:AA0037TT

18655-50-0 | 3-(4-Chlorophenyl)propan-1-amine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$30.00   $21.00
- +
250mg
95%
in stock  
$42.00   $29.00
- +
1g
95%
in stock  
$125.00   $87.00
- +
  • 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:
AA0037TT
Chemical Name:
3-(4-Chlorophenyl)propan-1-amine
CAS Number:
18655-50-0
Molecular Formula:
C9H12ClN
Molecular Weight:
169.6513
MDL Number:
MFCD06212968
SMILES:
NCCCc1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
97.7  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.2  

Upstream Synthesis Route

[1]Patent:EP525360,1993,A2,

[1]Patent:US2002/58659,2002,A1,

[1]Patent:US5242944,1993,A,

[1]JournalofMedicinalChemistry,1996,vol.39,#25,p.4942-4951

[1]BioorganicandMedicinalChemistryLetters,2013,vol.23,#23,p.6415-6420

Downstream Synthesis Route
18655-50-0   
3-(4-chloro-3-nitro-phenyl)-propylamine 

[1]JournaloftheAmericanChemicalSociety,1946,vol.68,p.1153

[1]Arzneimittel-Forschung/DrugResearch,1969,vol.19,p.1807-1819

[1]Arzneimittel-Forschung/DrugResearch,1969,vol.19,p.1807-1819

18655-50-0    4422-95-1   
Benzene-1,3,5-tricarboxylicacidtris-3-(4-chloro-phenyl)-propyl-amide} 

[1]ArchivderPharmazie,1987,vol.320,p.1233-1238

18655-50-0    184003-34-7   
1-3-(4-Chloro-phenyl)-propyl-3-(4-hydroxy-3-methoxy-benzyl)-thiourea 

[1]JournalofMedicinalChemistry,1996,vol.39,p.4942-4951

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

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