Home Other Building Blocks 4,7-difluoro-2,3-dihydro-1H-isoindol-1-one

4,7-difluoro-2,3-dihydro-1H-isoindol-1-one

CAS No.:
854762-47-3
Catalog Number:
AG01C99O
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
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Product Description
Catalog Number:
AG01C99O
Chemical Name:
4,7-difluoro-2,3-dihydro-1H-isoindol-1-one
CAS Number:
854762-47-3
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD12924480
IUPAC Name:
4,7-difluoro-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C8H5F2NO/c9-5-1-2-6(10)7-4(5)3-11-8(7)12/h1-2H,3H2,(H,11,12)
InChI Key:
FBIRCWQFZUEINW-UHFFFAOYSA-N
SMILES:
Fc1ccc(c2c1CNC2=O)F
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.131g/mol
Monoisotopic Mass:
169.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties