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Home > Fluorides > 1443344-87-3
1443344-87-3 | 5-(2,3,4-Trifluoro-phenoxy)pentanenitrile
CAS No: 1443344-87-3 Catalog No: AG01FBOI MDL No:
Product Description
Catalog Number:
AG01FBOI
Chemical Name:
5-(2,3,4-Trifluoro-phenoxy)pentanenitrile
CAS Number:
1443344-87-3
Molecular Formula:
C11H10F3NO
Molecular Weight:
229.1984
IUPAC Name:
5-(2,3,4-trifluorophenoxy)pentanenitrile
InChI:
InChI=1S/C11H10F3NO/c12-8-4-5-9(11(14)10(8)13)16-7-3-1-2-6-15/h4-5H,1-3,7H2
InChI Key:
QSUZWNOBZFXALU-UHFFFAOYSA-N
SMILES:
Fc1c(OCCCCC#N)ccc(c1F)F
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.071g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.202g/mol
Monoisotopic Mass:
229.071g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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