Home Other Building Blocks 1,4-Diiodotetrafluorobenzene

1,4-Diiodotetrafluorobenzene

CAS No.:
392-57-4
Catalog Number:
AG003DOM
Molecular Formula:
C6F4I2
Molecular Weight:
401.8668
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$38
- +
5g
95%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG003DOM
Chemical Name:
1,4-Diiodotetrafluorobenzene
CAS Number:
392-57-4
Molecular Formula:
C6F4I2
Molecular Weight:
401.8668
MDL Number:
MFCD00001055
IUPAC Name:
1,2,4,5-tetrafluoro-3,6-diiodobenzene
InChI:
InChI=1S/C6F4I2/c7-1-2(8)6(12)4(10)3(9)5(1)11
InChI Key:
VIXRAZODEODOJF-UHFFFAOYSA-N
SMILES:
Fc1c(I)c(F)c(c(c1F)I)F
EC Number:
206-877-8
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.803g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
401.869g/mol
Monoisotopic Mass:
401.803g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Literature
Title Journal
Quantifying homo- and heteromolecular hydrogen bonds as a guide for adduct formation. Chemistry (Weinheim an der Bergstrasse, Germany) 20120529
Cyclo-hexa-2,5-diene-1,4-dione-1,2,4,5-tetra-fluoro-3,6-diiodo-benzene (1/1). Acta crystallographica. Section E, Structure reports online 20120501
Energetic effects between halogen bonds and anion-π or lone pair-π interactions: a theoretical study. The journal of physical chemistry. A 20120315
Observation of a two-dimensional halogen-bonded cocrystal at sub-monolayer coverage using synchrotron X-ray diffraction. Chemical communications (Cambridge, England) 20110307
1,2,4,5-Tetra-fluoro-3,6-diiodo-benzene-2,3-bis-(pyridin-2-yl)pyrazine (1/1). Acta crystallographica. Section E, Structure reports online 20101101
1,2,4,5-Tetra-fluoro-3,6-diiodo-benzene-4-(pyridin-4-ylsulfan-yl)pyridine (1/1). Acta crystallographica. Section E, Structure reports online 20101001
Halogen bonding drives the self-assembly of piperazine cyclophanes into tubular structures. Chemical communications (Cambridge, England) 20090428
Halogen bonding between an isoindoline nitroxide and 1,4-diiodotetrafluorobenzene: new tools and tectons for self-assembling organic spin systems. Chemistry (Weinheim an der Bergstrasse, Germany) 20090101
Isostructural materials achieved by using structurally equivalent donors and acceptors in halogen-bonded cocrystals. Chemistry (Weinheim an der Bergstrasse, Germany) 20080101
Experimental electron density study of the supramolecular aggregation between 4,4'-dipyridyl-N,N'-dioxide and 1,4-diiodotetrafluorobenzene at 90 K. Acta crystallographica. Section B, Structural science 20041001
The experimental electron density distribution in the complex of (E)-1,2-bis(4-pyridyl)ethylene with 1,4-diiodotetrafluorobenzene at 90 K. Chemistry (Weinheim an der Bergstrasse, Germany) 20030404
Properties