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Home Amines 5202-89-1
5202-89-1,MFCD00007837
Catalog No.:AA003558

5202-89-1 | Methyl 2-amino-5-chlorobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$6.00   $4.00
- +
5g
95%
in stock  
$12.00   $8.00
- +
10g
97%
in stock  
$19.00   $13.00
- +
25g
97%
in stock  
$22.00   $15.00
- +
100g
97%
in stock  
$42.00   $29.00
- +
500g
97%
in stock  
$93.00   $65.00
- +
  • 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:
AA003558
Chemical Name:
Methyl 2-amino-5-chlorobenzoate
CAS Number:
5202-89-1
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
MDL Number:
MFCD00007837
SMILES:
COC(=O)c1cc(Cl)ccc1N
Properties
Properties
 
BP:
293.9°C at 760 mmHg  
Form:
Solid  
MP:
66-68 °C  
Refractive Index:
1.5560 (estimate)  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
174  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.3  

Upstream Synthesis Route

[1]Patent:EP1997812,2008,A1,.Locationinpatent:Page/Pagecolumn8

[2]JournaloftheChemicalSociety,1947,p.890,894

[3]BioorganicChemistry,2018,vol.80,p.433-443

[1]JournaloftheChemicalSociety,1947,p.890,894

[2]Patent:WO2015/164374,2015,A1,

[3]BioorganicChemistry,2018,vol.80,p.433-443

[1]Patent:WO2006/122631,2006,A1,

[1]JournaloftheChemicalSociety,1948,p.1759,1765

[1]Tetrahedron,1995,vol.51,#7,p.1861-1866

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1948,p.1759,1765

[1]Patent:WO2018/13776,2018,A1.Locationinpatent:Page/Pagecolumn136

[2]Patent:WO2018/13774,2018,A1.Locationinpatent:Page/Pagecolumn260

[3]ZhurnalObshcheiKhimii,1957,vol.27,p.1558,1559;engl.Ausg.S.1631,1632

[1]Patent:EP1997812,2008,A1.Locationinpatent:Page/Pagecolumn8

[2]JournaloftheChemicalSociety,1947,p.890,894

[3]BioorganicChemistry,2018,vol.80,p.433-443

[1]Farmaco,EdizioneScientifica,1979,vol.34,p.688-697

[1]Farmaco,EdizioneScientifica,1979,vol.34,p.688-697

Literature

Title: Methyl 4-(3-chloro-prop-oxy)benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20110501

Title: Methyl 2-amino-5-chloro-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20101101

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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SDS
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