Home Carboxys (R)-1-(tert-Butoxycarbonyl)-2-(4-(trifluoromethyl)benzyl)pyrrolidine-2-carboxylic acid

(R)-1-(tert-Butoxycarbonyl)-2-(4-(trifluoromethyl)benzyl)pyrrolidine-2-carboxylic acid

CAS No.:
957310-45-1
Catalog Number:
AG003OET
Molecular Formula:
C18H22F3NO4
Molecular Weight:
373.3668
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 99% (HPLC)
1 week
United States
$184
- +
250mg
≥ 99% (HPLC)
1 week
United States
$345
- +
1g
≥ 99% (HPLC)
1 week
United States
$696
- +
5g
≥ 99% (HPLC)
1 week
United States
$2494
- +
Product Description
Catalog Number:
AG003OET
Chemical Name:
(R)-1-(tert-Butoxycarbonyl)-2-(4-(trifluoromethyl)benzyl)pyrrolidine-2-carboxylic acid
CAS Number:
957310-45-1
Molecular Formula:
C18H22F3NO4
Molecular Weight:
373.3668
MDL Number:
MFCD06796802
IUPAC Name:
(2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C18H22F3NO4/c1-16(2,3)26-15(25)22-10-4-9-17(22,14(23)24)11-12-5-7-13(8-6-12)18(19,20)21/h5-8H,4,9-11H2,1-3H3,(H,23,24)/t17-/m1/s1
InChI Key:
NZVYODUEBIJKKN-QGZVFWFLSA-N
SMILES:
O=C(N1CCC[C@@]1(Cc1ccc(cc1)C(F)(F)F)C(=O)O)OC(C)(C)C
Properties
Complexity:
536  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
373.15g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
373.372g/mol
Monoisotopic Mass:
373.15g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties