Home Carbonyls 2-((tert-butoxycarbonyl)amino)-3-(2-cyanophenyl)propanoic acid

2-((tert-butoxycarbonyl)amino)-3-(2-cyanophenyl)propanoic acid

CAS No.:
226924-21-6
Catalog Number:
AG019F13
Molecular Formula:
C15H18N2O4
Molecular Weight:
290.3144
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$32
- +
250mg
95%
In Stock USA
United States
$56
- +
1g
95%
In Stock USA
United States
$111
- +
5g
95%
In Stock USA
United States
$333
- +
Product Description
Catalog Number:
AG019F13
Chemical Name:
2-((tert-butoxycarbonyl)amino)-3-(2-cyanophenyl)propanoic acid
CAS Number:
226924-21-6
Molecular Formula:
C15H18N2O4
Molecular Weight:
290.3144
MDL Number:
MFCD09756564
IUPAC Name:
3-(2-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C15H18N2O4/c1-15(2,3)21-14(20)17-12(13(18)19)8-10-6-4-5-7-11(10)9-16/h4-7,12H,8H2,1-3H3,(H,17,20)(H,18,19)
InChI Key:
AJHPGXZOIAYYDW-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1CC(C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
433  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.127g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
290.319g/mol
Monoisotopic Mass:
290.127g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties