Home Carboxys Boc-(2S,5R)-5-phenylpyrrolidine-2-carboxylic acid

Boc-(2S,5R)-5-phenylpyrrolidine-2-carboxylic acid

CAS No.:
221352-49-4
Catalog Number:
AG00BCKX
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$194
- +
1g
97%
In Stock USA
United States
$425
- +
5g
97%
In Stock USA
United States
$2050
- +
Product Description
Catalog Number:
AG00BCKX
Chemical Name:
Boc-(2S,5R)-5-phenylpyrrolidine-2-carboxylic acid
CAS Number:
221352-49-4
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
MDL Number:
MFCD01321008
IUPAC Name:
(2S,5R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-5-phenylpyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-12(9-10-13(17)14(18)19)11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H,18,19)/t12-,13+/m1/s1
InChI Key:
ADTXMICUZGOWDF-OLZOCXBDSA-N
SMILES:
OC(=O)[C@@H]1CC[C@@H](N1C(=O)OC(C)(C)C)c1ccccc1
Properties
Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties