Home Other Building Blocks 3-methyl-3-[3-(trifluoromethyl)phenyl]pyrrolidine hydrochloride

3-methyl-3-[3-(trifluoromethyl)phenyl]pyrrolidine hydrochloride

CAS No.:
1781945-18-3
Catalog Number:
AG01BB40
Molecular Formula:
C12H15ClF3N
Molecular Weight:
265.7024
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Product Description
Catalog Number:
AG01BB40
Chemical Name:
3-methyl-3-[3-(trifluoromethyl)phenyl]pyrrolidine hydrochloride
CAS Number:
1781945-18-3
Molecular Formula:
C12H15ClF3N
Molecular Weight:
265.7024
MDL Number:
MFCD27954427
IUPAC Name:
3-methyl-3-[3-(trifluoromethyl)phenyl]pyrrolidine;hydrochloride
InChI:
InChI=1S/C12H14F3N.ClH/c1-11(5-6-16-8-11)9-3-2-4-10(7-9)12(13,14)15;/h2-4,7,16H,5-6,8H2,1H3;1H
InChI Key:
AAJDCJPCLYAEFP-UHFFFAOYSA-N
SMILES:
CC1(CNCC1)c1cccc(c1)C(F)(F)F.Cl
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.085g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
265.704g/mol
Monoisotopic Mass:
265.085g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties