Home Other Building Blocks 2,2-dimethyl-3-[4-(trifluoromethyl)phenyl]pyrrolidine hydrochloride

2,2-dimethyl-3-[4-(trifluoromethyl)phenyl]pyrrolidine hydrochloride

CAS No.:
2059935-66-7
Catalog Number:
AG01BS6L
Molecular Formula:
C13H17ClF3N
Molecular Weight:
279.7290
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Product Description
Catalog Number:
AG01BS6L
Chemical Name:
2,2-dimethyl-3-[4-(trifluoromethyl)phenyl]pyrrolidine hydrochloride
CAS Number:
2059935-66-7
Molecular Formula:
C13H17ClF3N
Molecular Weight:
279.7290
MDL Number:
MFCD30536074
IUPAC Name:
2,2-dimethyl-3-[4-(trifluoromethyl)phenyl]pyrrolidine;hydrochloride
InChI:
InChI=1S/C13H16F3N.ClH/c1-12(2)11(7-8-17-12)9-3-5-10(6-4-9)13(14,15)16;/h3-6,11,17H,7-8H2,1-2H3;1H
InChI Key:
FBYLFYOGGKAPOJ-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)C1CCNC1(C)C)(F)F.Cl
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.1g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
279.731g/mol
Monoisotopic Mass:
279.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties