Home Carboxys 1-Pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-4-(trifluoromethyl)-,1,1-dimethylethyl ester, (2R,4S)-

1-Pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-4-(trifluoromethyl)-,1,1-dimethylethyl ester, (2R,4S)-

CAS No.:
497103-75-0
Catalog Number:
AG00ILCW
Molecular Formula:
C11H18F3NO3
Molecular Weight:
269.2607
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$302
- +
250mg
97%
1 week
United States
$566
- +
1g
97%
1 week
United States
$1357
- +
Product Description
Catalog Number:
AG00ILCW
Chemical Name:
1-Pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-4-(trifluoromethyl)-,1,1-dimethylethyl ester, (2R,4S)-
CAS Number:
497103-75-0
Molecular Formula:
C11H18F3NO3
Molecular Weight:
269.2607
MDL Number:
MFCD31618006
IUPAC Name:
tert-butyl (2R,4S)-2-(hydroxymethyl)-4-(trifluoromethyl)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C11H18F3NO3/c1-10(2,3)18-9(17)15-5-7(11(12,13)14)4-8(15)6-16/h7-8,16H,4-6H2,1-3H3/t7-,8+/m0/s1
InChI Key:
CRSWFECHMDRHHV-JGVFFNPUSA-N
SMILES:
OC[C@H]1C[C@@H](CN1C(=O)OC(C)(C)C)C(F)(F)F
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
269.124g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.264g/mol
Monoisotopic Mass:
269.124g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties