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80126-53-0,MFCD23135865
Catalog No.:AA00ID0M

80126-53-0 | L-2-Methylphenylalanine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$7.00   $5.00
- +
5g
95%
in stock  
$33.00   $23.00
- +
10g
95%
in stock  
$65.00   $46.00
- +
25g
95%
in stock  
$160.00   $112.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00ID0M
Chemical Name:
L-2-Methylphenylalanine
CAS Number:
80126-53-0
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
MDL Number:
MFCD23135865
SMILES:
OC(=O)C(Cc1ccccc1C)N
Properties
Computed Properties
 
Complexity:
182  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-1.2  

Upstream Synthesis Route

[1]AdvancedSynthesisandCatalysis,2017,vol.359,#9,p.1570-1576

[1]JournalofLabelledCompoundsandRadiopharmaceuticals,2011,vol.54,#2,p.80-85

[1]JournaloftheAmericanChemicalSociety,2015,vol.137,#40,p.12977-12983

[1]JournaloftheAmericanChemicalSociety,2015,vol.137,#40,p.12977-12983

[1]JournalofOrganicChemistry,2009,vol.74,#23,p.9152-9157

Downstream Synthesis Route
2-Oxo-3-o-tolyl-propionicacidanion 
  80126-53-0 

[1]TetrahedronLetters,1987,vol.28,p.3745-3746

80126-53-0   
(R)-3-amino-3-(2-methylphenyl)propionicacid 

[1]JournaloftheAmericanChemicalSociety,2007,vol.129,p.6988-6989

[1]JournalofMedicinalChemistry,2007,vol.50,p.2753-2766

[1]JournalofMedicinalChemistry,2007,vol.50,p.2753-2766

80126-53-0   
C19H23N3O2*HCl 

[1]JournalofMedicinalChemistry,2007,vol.50,p.2753-2766

Literature

Title: Preparative separation and identification of derivatized beta-methylphenylalanine enantiomers by chiral SFC, HPLC and NMR for development of new peptide ligand mimetics in drug discovery.

Journal: Journal of pharmaceutical and biomedical analysis 20060303

Title: Discovery of potent, selective, and orally bioavailable pyridone-based dipeptidyl peptidase-4 inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20060301

Title: Discovery of potent and selective phenylalanine based dipeptidyl peptidase IV inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20050516

Title: Modifications to the N-terminus but not the C-terminus of calcitonin gene-related peptide(8-37) produce antagonists with increased affinity.

Journal: Journal of medicinal chemistry 20030605

Title: Magnesium and biological activity of oxytocin analogues modified on aromatic ring of amino acid in position 2.

Journal: Journal of peptide science : an official publication of the European Peptide Society 20010801

Quotation Request
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SDS
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Tags:80126-53-0 Molecular Formula|80126-53-0 MDL|80126-53-0 SMILES|80126-53-0 L-2-Methylphenylalanine
Catalog No.: AA00ID0M
80126-53-0,MFCD23135865
80126-53-0 | L-2-Methylphenylalanine
Pack Size： 1g
Purity： 95%
in stock
$7.00 $5.00
Pack Size： 5g
Purity： 95%
in stock
$33.00 $23.00
Pack Size： 10g
Purity： 95%
in stock
$65.00 $46.00
Pack Size： 25g
Purity： 95%
in stock
$160.00 $112.00
Quantity
- +
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Technical Information
Catalog Number: AA00ID0M
Chemical Name: L-2-Methylphenylalanine
CAS Number: 80126-53-0
Molecular Formula: C10H13NO2
Molecular Weight: 179.2157
MDL Number: MFCD23135865
SMILES: OC(=O)C(Cc1ccccc1C)N
Properties
Complexity: 182  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -1.2  
Upstream Synthesis Route
68208-16-2    939-57-1    80126-53-0 

[1]AdvancedSynthesisandCatalysis,2017,vol.359,#9,p.1570-1576

1111643-38-9    80126-53-0 

[1]JournalofLabelledCompoundsandRadiopharmaceuticals,2011,vol.54,#2,p.80-85

2373-76-4    736131-48-9    80126-53-0 

[1]JournaloftheAmericanChemicalSociety,2015,vol.137,#40,p.12977-12983

2373-76-4    736131-48-9    80126-53-0 

[1]JournaloftheAmericanChemicalSociety,2015,vol.137,#40,p.12977-12983

939-57-1    80126-53-0 

[1]JournalofOrganicChemistry,2009,vol.74,#23,p.9152-9157

Downstream Synthesis Route
2-Oxo-3-o-tolyl-propionicacidanion 
  80126-53-0 

[1]TetrahedronLetters,1987,vol.28,p.3745-3746

80126-53-0   
(R)-3-amino-3-(2-methylphenyl)propionicacid 

[1]JournaloftheAmericanChemicalSociety,2007,vol.129,p.6988-6989

24424-99-5    80126-53-0    80102-29-0 

[1]JournalofMedicinalChemistry,2007,vol.50,p.2753-2766

80126-53-0    943726-70-3 

[1]JournalofMedicinalChemistry,2007,vol.50,p.2753-2766

80126-53-0   
C19H23N3O2*HCl 

[1]JournalofMedicinalChemistry,2007,vol.50,p.2753-2766

Literature fold

Title: Preparative separation and identification of derivatized beta-methylphenylalanine enantiomers by chiral SFC, HPLC and NMR for development of new peptide ligand mimetics in drug discovery.

Journal: Journal of pharmaceutical and biomedical analysis20060303

Title: Discovery of potent, selective, and orally bioavailable pyridone-based dipeptidyl peptidase-4 inhibitors.

Journal: Bioorganic & medicinal chemistry letters20060301

Title: Discovery of potent and selective phenylalanine based dipeptidyl peptidase IV inhibitors.

Journal: Bioorganic & medicinal chemistry letters20050516

Title: Modifications to the N-terminus but not the C-terminus of calcitonin gene-related peptide(8-37) produce antagonists with increased affinity.

Journal: Journal of medicinal chemistry20030605

Title: Magnesium and biological activity of oxytocin analogues modified on aromatic ring of amino acid in position 2.

Journal: Journal of peptide science : an official publication of the European Peptide Society20010801

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