Home Other Building Blocks 4,4-difluoropyrrolidin-2-one

4,4-difluoropyrrolidin-2-one

CAS No.:
1785332-67-3
Catalog Number:
AG01AULS
Molecular Formula:
C4H5F2NO
Molecular Weight:
121.0854
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Product Description
Catalog Number:
AG01AULS
Chemical Name:
4,4-difluoropyrrolidin-2-one
CAS Number:
1785332-67-3
Molecular Formula:
C4H5F2NO
Molecular Weight:
121.0854
MDL Number:
MFCD29060257
IUPAC Name:
4,4-difluoropyrrolidin-2-one
InChI:
InChI=1S/C4H5F2NO/c5-4(6)1-3(8)7-2-4/h1-2H2,(H,7,8)
InChI Key:
PVNTVEUEDNMWIV-UHFFFAOYSA-N
SMILES:
O=C1NCC(C1)(F)F
Properties
Complexity:
123  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.034g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
121.087g/mol
Monoisotopic Mass:
121.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties