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2486-70-6,MFCD00007736
Catalog No.:AA002PLK

2486-70-6 | 4-Amino-3-methylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$6.00   $4.00
- +
5g
97%
in stock  
$7.00   $5.00
- +
10g
97%
in stock  
$10.00   $7.00
- +
25g
97%
in stock  
$19.00   $13.00
- +
100g
≥98%
in stock  
$46.00   $32.00
- +
500g
98%(HPLC)
in stock  
$167.00   $117.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002PLK
Chemical Name:
4-Amino-3-methylbenzoic acid
CAS Number:
2486-70-6
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD00007736
SMILES:
OC(=O)c1ccc(c(c1)C)N
NSC Number:
227945
Properties
Properties
 
BP:
339.5°C at 760 mmHg  
Form:
Solid  
MP:
169-171 °C(lit.)  
Refractive Index:
1.5810 (estimate)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
158  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.8  

Upstream Synthesis Route

[1]Patent:US2012/277224,2012,A1,

[1]JustusLiebigsAnnalenderChemie,1867,vol.144,p.182

[1]Patent:WO2006/51477,2006,A2,.Locationinpatent:Page/Pagecolumn54

[2]AmericanChemicalJournal,1881,vol.3,p.431

[3]Patent:US5409928,1995,A,

[1]AdvancedSynthesisandCatalysis,2010,vol.352,#9,p.1451-1454

[2]Patent:WO2014/66795,2014,A1,.Locationinpatent:Paragraph0175

[3]JournalofOrganicChemistry,2008,vol.73,#21,p.8631-8634

[4]Patent:CN106831460,2017,A,.Locationinpatent:Paragraph0029-0059

[5]Patent:CN107501106,2017,A,.Locationinpatent:Paragraph0025-0047

[6]Patent:WO2006/51477,2006,A2,.Locationinpatent:Page/Pagecolumn53-54

[7]Organometallics,2010,vol.29,#18,p.4135-4138

[8]ChemischeBerichte,1909,vol.42,p.433

[9]JustusLiebigsAnnalenderChemie,1867,vol.144,p.182

[10]ChineseChemicalLetters,2016,vol.27,#1,p.109-113

[1]ChemischeBerichte,1909,vol.42,p.433

[2]ChemischeBerichte,1909,vol.42,p.433

[3]ChemischeBerichte,1909,vol.42,p.433

Downstream Synthesis Route

[1]JustusLiebigsAnnalenderChemie,1867,vol.144,p.182

[1]Patent:DE2050087,1972,    Chem.Abstr.,1972,vol.77

[1]JournalofOrganicChemistry,1980,vol.45,p.2195-2201

[1]JournalofMedicinalChemistry,1983,vol.26,p.85-90

[1]HelveticaChimicaActa,1979,vol.62,p.271-303

Literature

Title: Production of the monoclonal antibody against Sudan 2 for immunoassay of Sudan dyes in egg.

Journal: Analytical biochemistry 20120415

Title: Ethyl 4-amino-3-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080501

Title: Methyl 4-amino-3-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080501

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

Journal: Chemical research in toxicology 20050601

Quotation Request
Company Name:
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Quantity Required:
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Additional Info:
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SDS
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Tags:2486-70-6 Molecular Formula|2486-70-6 MDL|2486-70-6 SMILES|2486-70-6 4-Amino-3-methylbenzoic acid
Catalog No.: AA002PLK
2486-70-6,MFCD00007736
2486-70-6 | 4-Amino-3-methylbenzoic acid
Pack Size： 1g
Purity： 97%
in stock
$6.00 $4.00
Pack Size： 5g
Purity： 97%
in stock
$7.00 $5.00
Pack Size： 10g
Purity： 97%
in stock
$10.00 $7.00
Pack Size： 25g
Purity： 97%
in stock
$19.00 $13.00
Pack Size： 100g
Purity： ≥98%
in stock
$46.00 $32.00
Pack Size： 500g
Purity： 98%(HPLC)
in stock
$167.00 $117.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002PLK
Chemical Name: 4-Amino-3-methylbenzoic acid
CAS Number: 2486-70-6
Molecular Formula: C8H9NO2
Molecular Weight: 151.1626
MDL Number: MFCD00007736
SMILES: OC(=O)c1ccc(c(c1)C)N
NSC Number: 227945
Properties
BP: 339.5°C at 760 mmHg  
Form: Solid  
MP: 169-171 °C(lit.)  
Refractive Index: 1.5810 (estimate)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 158  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.8  
Upstream Synthesis Route
2486-70-6    61700-61-6 

[1]Patent:US2012/277224,2012,A1,

2486-70-6    7697-29-2 

[1]JustusLiebigsAnnalenderChemie,1867,vol.144,p.182

2486-70-6    7697-28-1 

[1]Patent:WO2006/51477,2006,A2,.Locationinpatent:Page/Pagecolumn54

[2]AmericanChemicalJournal,1881,vol.3,p.431

[3]Patent:US5409928,1995,A,

3113-71-1    2486-70-6 

[1]AdvancedSynthesisandCatalysis,2010,vol.352,#9,p.1451-1454

[2]Patent:WO2014/66795,2014,A1,.Locationinpatent:Paragraph0175

[3]JournalofOrganicChemistry,2008,vol.73,#21,p.8631-8634

[4]Patent:CN106831460,2017,A,.Locationinpatent:Paragraph0029-0059

[5]Patent:CN107501106,2017,A,.Locationinpatent:Paragraph0025-0047

[6]Patent:WO2006/51477,2006,A2,.Locationinpatent:Page/Pagecolumn53-54

[7]Organometallics,2010,vol.29,#18,p.4135-4138

[8]ChemischeBerichte,1909,vol.42,p.433

[9]JustusLiebigsAnnalenderChemie,1867,vol.144,p.182

[10]ChineseChemicalLetters,2016,vol.27,#1,p.109-113

99-04-7    2486-70-6 

[1]ChemischeBerichte,1909,vol.42,p.433

[2]ChemischeBerichte,1909,vol.42,p.433

[3]ChemischeBerichte,1909,vol.42,p.433

Downstream Synthesis Route
2486-70-6    7697-29-2 

[1]JustusLiebigsAnnalenderChemie,1867,vol.144,p.182

2486-70-6    79-22-1    37653-90-0 

[1]Patent:DE2050087,1972,    Chem.Abstr.,1972,vol.77

71-23-8    2486-70-6    73274-30-3 

[1]JournalofOrganicChemistry,1980,vol.45,p.2195-2201

616-02-4    2486-70-6    83560-89-8 

[1]JournalofMedicinalChemistry,1983,vol.26,p.85-90

2486-70-6    40800-65-5 

[1]HelveticaChimicaActa,1979,vol.62,p.271-303

Literature fold

Title: Production of the monoclonal antibody against Sudan 2 for immunoassay of Sudan dyes in egg.

Journal: Analytical biochemistry20120415

Title: Ethyl 4-amino-3-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online20080501

Title: Methyl 4-amino-3-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online20080501

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

Journal: Chemical research in toxicology20050601

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