72408-57-2,MFCD02662604
Catalog No.:AA01AIYA

72408-57-2 | 2-Amino-2-(4-bromophenyl)propanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$359.00   $252.00
- +
500mg
97%
in stock  
$507.00   $355.00
- +
1g
97%
in stock  
$720.00   $504.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01AIYA
Chemical Name:
2-Amino-2-(4-bromophenyl)propanoic acid
CAS Number:
72408-57-2
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD02662604
SMILES:
OC(=O)C(c1ccc(cc1)Br)(N)C
Properties
Computed Properties
 
Complexity:
202  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-0.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2019/84026,2019,A1Locationinpatent:Paragraph0652;0653

[2]Stilz,H.U.;Beck,G.;Jablonka,B.;Just,M.[BulletindesSocietesChimiquesBelges,1996,vol.105,#10-11,p.711-720]

[3]Stilz;Guba;Jablonka;Just;Klingler;König;Wehner;Zoller[JournalofMedicinalChemistry,2001,vol.44,#8,p.1158-1176]

[4]CurrentPatentAssignee:GILEADSCIENCESINC-WO2010/132601,2010,A1Locationinpatent:Page/Pagecolumn427

[5]Galley,Guido;Beurier,Angélica;Décoret,Guillaume;Goergler,Annick;Hutter,Roman;Mohr,Susanne;Pähler,Axel;Schmid,Philipp;Türck,Dietrich;Unger,Robert;Zbinden,KatrinGroebke;Hoener,MariusC.;Norcross,RogerD.[ACSMedicinalChemistryLetters,2016,vol.7,#2,p.192-197]

[6]Washburn;Sun;Bisacchi;Wu;Cheng;Sher;Ryono;Gavai;Poss;Girotra;McCann;Mikkilineni;Dejneka;Wang;Merchant;Morella;Arbeeny;Harper;Slusarchyk;Skwish;Russell;Allen;Tesfamariam;Frohlich;Abboa-Offei;Cap;Waldron;George;Young;Dickinson;Seymour[BioorganicandMedicinalChemistryLetters,2004,vol.14,#13,p.3525-3529]

Literature
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SDS
Tags:72408-57-2 Molecular Formula|72408-57-2 MDL|72408-57-2 SMILES|72408-57-2 2-Amino-2-(4-bromophenyl)propanoic acid
Catalog No.: AA01AIYA
72408-57-2,MFCD02662604
72408-57-2 | 2-Amino-2-(4-bromophenyl)propanoic acid
Pack Size: 250mg
Purity: 97%
in stock
$359.00 $252.00
Pack Size: 500mg
Purity: 97%
in stock
$507.00 $355.00
Pack Size: 1g
Purity: 97%
in stock
$720.00 $504.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01AIYA
Chemical Name: 2-Amino-2-(4-bromophenyl)propanoic acid
CAS Number: 72408-57-2
Molecular Formula: C9H10BrNO2
Molecular Weight: 244.0852
MDL Number: MFCD02662604
SMILES: OC(=O)C(c1ccc(cc1)Br)(N)C
Properties
Complexity: 202  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 1  
XLogP3: -0.8  
Downstream Synthesis Route
6320-50-9    72408-57-2 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2019/84026,2019,A1Locationinpatent:Paragraph0652;0653

[2]Stilz,H.U.;Beck,G.;Jablonka,B.;Just,M.[BulletindesSocietesChimiquesBelges,1996,vol.105,#10-11,p.711-720]

[3]Stilz;Guba;Jablonka;Just;Klingler;König;Wehner;Zoller[JournalofMedicinalChemistry,2001,vol.44,#8,p.1158-1176]

[4]CurrentPatentAssignee:GILEADSCIENCESINC-WO2010/132601,2010,A1Locationinpatent:Page/Pagecolumn427

[5]Galley,Guido;Beurier,Angélica;Décoret,Guillaume;Goergler,Annick;Hutter,Roman;Mohr,Susanne;Pähler,Axel;Schmid,Philipp;Türck,Dietrich;Unger,Robert;Zbinden,KatrinGroebke;Hoener,MariusC.;Norcross,RogerD.[ACSMedicinalChemistryLetters,2016,vol.7,#2,p.192-197]

[6]Washburn;Sun;Bisacchi;Wu;Cheng;Sher;Ryono;Gavai;Poss;Girotra;McCann;Mikkilineni;Dejneka;Wang;Merchant;Morella;Arbeeny;Harper;Slusarchyk;Skwish;Russell;Allen;Tesfamariam;Frohlich;Abboa-Offei;Cap;Waldron;George;Young;Dickinson;Seymour[BioorganicandMedicinalChemistryLetters,2004,vol.14,#13,p.3525-3529]

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