Home Other Building Blocks 5-(difluoromethyl)-5-methylpyrrolidine-2,4-dione

5-(difluoromethyl)-5-methylpyrrolidine-2,4-dione

CAS No.:
2103987-18-2
Catalog Number:
AG01DX6B
Molecular Formula:
C6H7F2NO2
Molecular Weight:
163.1221
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Product Description
Catalog Number:
AG01DX6B
Chemical Name:
5-(difluoromethyl)-5-methylpyrrolidine-2,4-dione
CAS Number:
2103987-18-2
Molecular Formula:
C6H7F2NO2
Molecular Weight:
163.1221
MDL Number:
MFCD31667059
IUPAC Name:
5-(difluoromethyl)-5-methylpyrrolidine-2,4-dione
InChI:
InChI=1S/C6H7F2NO2/c1-6(5(7)8)3(10)2-4(11)9-6/h5H,2H2,1H3,(H,9,11)
InChI Key:
BLJUIFYLQBCVQJ-UHFFFAOYSA-N
SMILES:
FC(C1(C)NC(=O)CC1=O)F
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.044g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.124g/mol
Monoisotopic Mass:
163.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties