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18062-97-0 | 2,6-Difluoro-phenoxyacetonitrile
CAS No: 18062-97-0 Catalog No: AG01FER1 MDL No:MFCD09475445
Product Description
Catalog Number:
AG01FER1
Chemical Name:
2,6-Difluoro-phenoxyacetonitrile
CAS Number:
18062-97-0
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD09475445
IUPAC Name:
2-(2,6-difluorophenoxy)acetonitrile
InChI:
InChI=1S/C8H5F2NO/c9-6-2-1-3-7(10)8(6)12-5-4-11/h1-3H,5H2
InChI Key:
NHIZAYZZXMIFLW-UHFFFAOYSA-N
SMILES:
N#CCOc1c(F)cccc1F
Properties
Complexity:
179
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:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.131g/mol
Monoisotopic Mass:
169.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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