+1 858-523-8231
Login | Register
AA Blocks, Building Blocks, Catalysts, Inhibitors
Login | Register
Home Amines 718596-77-1
718596-77-1,MFCD04117832
Catalog No.:AA005PIS

718596-77-1 | (S)-3-Amino-3-(4-cyano-phenyl)-propionic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$75.00   $53.00
- +
1g
96%
in stock  
$112.00   $78.00
- +
5g
96%
in stock  
$502.00   $352.00
- +
25g
96%
in stock  
$2,422.00   $1,696.00
- +
  • 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:
AA005PIS
Chemical Name:
(S)-3-Amino-3-(4-cyano-phenyl)-propionic acid
CAS Number:
718596-77-1
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD04117832
SMILES:
N[C@H](c1ccc(cc1)C#N)CC(=O)O
Properties
Properties
 
BP:
395.4°C at 760 mmHg  
Form:
Solid  
MP:
229-231℃(Solv: water (7732-18-5); acetone (67-64-1))  
Stability:
Air Sensitive  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
248  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
-1.7  

Upstream Synthesis Route

[1]TetrahedronAsymmetry,2004,vol.15,#12,p.1893-1897

[1]TetrahedronAsymmetry,2004,vol.15,#12,p.1893-1897

[1]TetrahedronAsymmetry,2004,vol.15,#12,p.1893-1897

Downstream Synthesis Route
738606-23-0    718596-77-1   
(S)-3-Amino-3-(4-carbamoyl-phenyl)-propionicacid 

[1]TetrahedronAsymmetry,2004,vol.15,p.1893-1897

[1]TetrahedronAsymmetry,2004,vol.15,p.1893-1897

[1]TetrahedronAsymmetry,2004,vol.15,p.1893-1897

6560-65-2    718596-77-1   
C21H21N3O4 

[1]Patent:US2006/94749,2006,A1.Locationinpatent:Page/Pagecolumn25

n-propyl3-amino-3-(4-cyanophenyl)propionate 
 
C13H16N2O2 
  718596-77-1 

[1]Organicprocessresearchanddevelopment,2011,vol.15,p.1201-1206

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Related Products of 718596-77-1
100-46-9

100-46-9

 102-48-7

102-48-7

 2018-90-8

2018-90-8

 118-31-0

118-31-0

 89-93-0

89-93-0

 93324-65-3

93324-65-3
Building Blocks
More >
Tags:718596-77-1 Molecular Formula|718596-77-1 MDL|718596-77-1 SMILES|718596-77-1 (S)-3-Amino-3-(4-cyano-phenyl)-propionic acid