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1373255-09-4,MFCD22194317
Catalog No.:AA007LHT
1373255-09-4 | (S);-4,4-Difluoropyrrolidine-2-carboxylic acid compound with 2,2,2-trifluoroacetic acid (1:1);
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50mg
95%
1 week  
$377.00
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250mg
95%
1 week  
$1,049.00
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Technical Information
Catalog Number:
AA007LHT
Chemical Name:
(S);-4,4-Difluoropyrrolidine-2-carboxylic acid compound with 2,2,2-trifluoroacetic acid (1:1);
CAS Number:
1373255-09-4
Molecular Formula:
C7H8F5NO4
Molecular Weight:
265.1347
MDL Number:
MFCD22194317
IUPAC Name:
(2S)-4,4-difluoropyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C5H7F2NO2.C2HF3O2/c6-5(7)1-3(4(9)10)8-2-5;3-2(4,5)1(6)7/h3,8H,1-2H2,(H,9,10);(H,6,7)/t3-;/m0./s1
InChI Key:
MNSASDZHAJGODJ-DFWYDOINSA-N
SMILES:
OC(=O)C(F)(F)F.OC(=O)[C@H]1NCC(C1)(F)F
Properties
Computed Properties
 
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
265.037g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
265.136g/mol
Monoisotopic Mass:
265.037g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1373255-09-4 
(S)-4,4-Difluoropyrrolidine-2-carboxylic acid 2,2,2-trifluoroacetic acid 
ANW-64226 
MFCD22194317 
AKOS015919616 
PB27295 
AK-76928 
AS-30888 
BR-76928 
AB0035608 
AX8223179 
TC-152971 
(S)-4,4-Difluoropyrrolidine-2-carboxylic acid compound with 2,2,2-trifluoroacetic acid (1:1) 
CS-0054754 
ST24020832 
X9985 
Q-2423 
(S)-4,4-Difluoro-2-pyrrolidinecarboxylic Acid Trifluoroacetate 
(S)-4,4-difluoropyrrolidine-2-carboxylic acid trifluoroacetic acid salt 
(S)-4,4-DIFLUOROPYRROLIDINE-2-CARBOXYLIC ACID 2,2,2-TRIFLUOROACETATE 
(S)-4,4-Difluoropyrrolidine-2-carboxylic acid compound with 2,2,2-trifluoroacetic acid (1 
(S)-4,4-Difluoropyrrolidine-2-carboxylicacid2,2,2-trifluoroacetate 
N/A 
(S)-4,4-Difluoropyrrolidine-2-carboxylic acid 2,2,2-trifluoroacetate 
C7H8F5NO4 
4,4-Difluoro-L-proline--trifluoroacetic acid (1/1) 
SCHEMBL17924705 
CTK8C0135 
DTXSID70719253 
MNSASDZHAJGODJ-DFWYDOINSA-N 
Literature
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