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Home > Fluorides > 850429-64-0
850429-64-0 | 4,5-Difluoroindolin-2-one
CAS No: 850429-64-0 Catalog No: AG004ZI7 MDL No:MFCD04112481
Product Description
Catalog Number:
AG004ZI7
Chemical Name:
4,5-Difluoroindolin-2-one
CAS Number:
850429-64-0
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD04112481
IUPAC Name:
4,5-difluoro-1,3-dihydroindol-2-one
InChI:
InChI=1S/C8H5F2NO/c9-5-1-2-6-4(8(5)10)3-7(12)11-6/h1-2H,3H2,(H,11,12)
InChI Key:
YUPHSWQGQCGBQH-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(F)c(cc2)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
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