Home Other Building Blocks 4-(difluoromethyl)pyrrolidin-2-one

4-(difluoromethyl)pyrrolidin-2-one

CAS No.:
1803589-29-8
Catalog Number:
AG01BAO7
Molecular Formula:
C5H7F2NO
Molecular Weight:
135.1120
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Product Description
Catalog Number:
AG01BAO7
Chemical Name:
4-(difluoromethyl)pyrrolidin-2-one
CAS Number:
1803589-29-8
Molecular Formula:
C5H7F2NO
Molecular Weight:
135.1120
MDL Number:
MFCD22413075
IUPAC Name:
4-(difluoromethyl)pyrrolidin-2-one
InChI:
InChI=1S/C5H7F2NO/c6-5(7)3-1-4(9)8-2-3/h3,5H,1-2H2,(H,8,9)
InChI Key:
OCJFFBJHASDJJJ-UHFFFAOYSA-N
SMILES:
O=C1NCC(C1)C(F)F
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.05g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
135.114g/mol
Monoisotopic Mass:
135.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties