Home Other Building Blocks 3-fluoro-3-[2-(trifluoromethoxy)phenyl]pyrrolidine hydrochloride

3-fluoro-3-[2-(trifluoromethoxy)phenyl]pyrrolidine hydrochloride

CAS No.:
1803583-79-0
Catalog Number:
AG01B813
Molecular Formula:
C11H12ClF4NO
Molecular Weight:
285.6657
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Product Description
Catalog Number:
AG01B813
Chemical Name:
3-fluoro-3-[2-(trifluoromethoxy)phenyl]pyrrolidine hydrochloride
CAS Number:
1803583-79-0
Molecular Formula:
C11H12ClF4NO
Molecular Weight:
285.6657
MDL Number:
MFCD28145598
IUPAC Name:
3-fluoro-3-[2-(trifluoromethoxy)phenyl]pyrrolidine;hydrochloride
InChI:
InChI=1S/C11H11F4NO.ClH/c12-10(5-6-16-7-10)8-3-1-2-4-9(8)17-11(13,14)15;/h1-4,16H,5-7H2;1H
InChI Key:
XGEKXJSYRPQAHT-UHFFFAOYSA-N
SMILES:
FC(Oc1ccccc1C1(F)CNCC1)(F)F.Cl
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.054g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
285.667g/mol
Monoisotopic Mass:
285.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties