Home Fluorides 1000198-76-4
1000198-76-4,MFCD12407011
Catalog No.:AA000083
Pyrrolidine, 3-[4-(trifluoromethyl)phenyl]- | 1000198-76-4
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100mg
95.0%
1 week  
$181.00
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000083
Chemical Name:
Pyrrolidine, 3-[4-(trifluoromethyl)phenyl]-
CAS Number:
1000198-76-4
Molecular Formula:
C11H12F3N
Molecular Weight:
215.2149
MDL Number:
MFCD12407011
IUPAC Name:
3-[4-(trifluoromethyl)phenyl]pyrrolidine
InChI:
InChI=1S/C11H12F3N/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9/h1-4,9,15H,5-7H2
InChI Key:
MMHBTMCYKWWNNS-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)C1CNCC1)(F)F
Properties
Computed Properties
 
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.092g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.219g/mol
Monoisotopic Mass:
215.092g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Synonyms
 
1000198-76-4 
3-[4-(trifluoromethyl)phenyl]pyrrolidine 
MFCD12407011 
AKOS011343754 
3-(4-Trifluoromethylphenyl)pyrrolidine 
PB26841 
3-(4-trifluoromethyl-phenyl)pyrrolidine 
AS-50919 
DB-058211 
AM20020062 
CS-0053740 
FT-0761724 
3-(4-(Trifluoromethyl)phenyl)pyrrolidine 
Pyrrolidine, 3-[4-(trifluoromethyl)phenyl] 
Pyrrolidine, 3-[4-(trifluoromethyl)phenyl]- 
Q-2778 
F2148-1386 
C11H12F3N 
CID3865706 
3-[4-(Trifluoromethyl)phenyl]-pyrrolidine 
3-(4-TRIFLUOROMETHYL-PHENYL)-PYRROLIDINE 
AC1MZ1US 
SCHEMBL1811550 
DTXSID30397591 
MMHBTMCYKWWNNS-UHFFFAOYSA-N 
2112AJ 
Literature
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