Home Carboxys Trans-4-(2-(trifluoromethyl)phenyl)pyrrolidine-3-carboxylic acid hydrochloride

Trans-4-(2-(trifluoromethyl)phenyl)pyrrolidine-3-carboxylic acid hydrochloride

CAS No.:
1049978-59-7
Catalog Number:
AG008UHR
Molecular Formula:
C12H13ClF3NO2
Molecular Weight:
295.6853
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
≥ 98% (HPLC)
1 week
United States
$111
- +
100mg
≥ 98% (HPLC)
1 week
United States
$162
- +
250mg
≥ 98% (HPLC)
1 week
United States
$279
- +
Product Description
Catalog Number:
AG008UHR
Chemical Name:
Trans-4-(2-(trifluoromethyl)phenyl)pyrrolidine-3-carboxylic acid hydrochloride
CAS Number:
1049978-59-7
Molecular Formula:
C12H13ClF3NO2
Molecular Weight:
295.6853
MDL Number:
MFCD06804651
IUPAC Name:
(3R,4S)-4-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C12H12F3NO2.ClH/c13-12(14,15)10-4-2-1-3-7(10)8-5-16-6-9(8)11(17)18;/h1-4,8-9,16H,5-6H2,(H,17,18);1H/t8-,9+;/m1./s1
InChI Key:
YSYNBLMPHGKCFM-RJUBDTSPSA-N
SMILES:
OC(=O)[C@H]1CNC[C@@H]1c1ccccc1C(F)(F)F.Cl
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
295.059g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
295.686g/mol
Monoisotopic Mass:
295.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties