Home Other Building Blocks 3-{[4-(difluoromethyl)phenyl]methyl}pyrrolidine

3-{[4-(difluoromethyl)phenyl]methyl}pyrrolidine

CAS No.:
1337424-40-4
Catalog Number:
AG01ABZL
Molecular Formula:
C12H15F2N
Molecular Weight:
211.2510
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Product Description
Catalog Number:
AG01ABZL
Chemical Name:
3-{[4-(difluoromethyl)phenyl]methyl}pyrrolidine
CAS Number:
1337424-40-4
Molecular Formula:
C12H15F2N
Molecular Weight:
211.2510
MDL Number:
MFCD24225542
IUPAC Name:
3-[[4-(difluoromethyl)phenyl]methyl]pyrrolidine
InChI:
InChI=1S/C12H15F2N/c13-12(14)11-3-1-9(2-4-11)7-10-5-6-15-8-10/h1-4,10,12,15H,5-8H2
InChI Key:
FBQHGDMSGNUKMU-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)CC1CNCC1)F
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.117g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.256g/mol
Monoisotopic Mass:
211.117g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties