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Home > Bromides > 1443337-17-4
1443337-17-4 | 6-(4-Bromo-2,5-difluoro-phenoxy)hexanenitrile
CAS No: 1443337-17-4 Catalog No: AG01FAEM MDL No:
Product Description
Catalog Number:
AG01FAEM
Chemical Name:
6-(4-Bromo-2,5-difluoro-phenoxy)hexanenitrile
CAS Number:
1443337-17-4
Molecular Formula:
C12H12BrF2NO
Molecular Weight:
304.1306
IUPAC Name:
6-(4-bromo-2,5-difluorophenoxy)hexanenitrile
InChI:
InChI=1S/C12H12BrF2NO/c13-9-7-11(15)12(8-10(9)14)17-6-4-2-1-3-5-16/h7-8H,1-4,6H2
InChI Key:
IPLCOFBHPKLUQI-UHFFFAOYSA-N
SMILES:
Fc1cc(Br)c(cc1OCCCCCC#N)F
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.007g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.135g/mol
Monoisotopic Mass:
303.007g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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