Home Other Building Blocks 4-(3,4-difluorophenyl)pyrrolidin-2-one

4-(3,4-difluorophenyl)pyrrolidin-2-one

CAS No.:
875446-03-0
Catalog Number:
AG01DSXG
Molecular Formula:
C10H9F2NO
Molecular Weight:
197.1814
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Product Description
Catalog Number:
AG01DSXG
Chemical Name:
4-(3,4-difluorophenyl)pyrrolidin-2-one
CAS Number:
875446-03-0
Molecular Formula:
C10H9F2NO
Molecular Weight:
197.1814
MDL Number:
MFCD21691559
IUPAC Name:
4-(3,4-difluorophenyl)pyrrolidin-2-one
InChI:
InChI=1S/C10H9F2NO/c11-8-2-1-6(3-9(8)12)7-4-10(14)13-5-7/h1-3,7H,4-5H2,(H,13,14)
InChI Key:
WEBXSXICEYKMAI-UHFFFAOYSA-N
SMILES:
O=C1NCC(C1)c1ccc(c(c1)F)F
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.065g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.185g/mol
Monoisotopic Mass:
197.065g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties