1,4-Diiodotetrafluorobenzene - CAS 392-57-4
Catalog: |
BB023918 |
Product Name: |
1,4-Diiodotetrafluorobenzene |
CAS: |
392-57-4 |
Synonyms: |
1,2,4,5-tetrafluoro-3,6-diiodobenzene |
IUPAC Name: | 1,2,4,5-tetrafluoro-3,6-diiodobenzene |
Description: | 1,4-Diiodotetrafluorobenzene (CAS# 392-57-4) is potential therapeutic agents, Polymethoxylated Flavones Isolated from Kaempferia Parviflora for cataract prevention through inhibition of matrix metalloproteinase-9 in lens epithelial cells. |
Molecular Weight: | 401.87 |
Molecular Formula: | C6F4I2 |
Canonical SMILES: | C1(=C(C(=C(C(=C1I)F)F)I)F)F |
InChI: | InChI=1S/C6F4I2/c7-1-2(8)6(12)4(10)3(9)5(1)11 |
InChI Key: | VIXRAZODEODOJF-UHFFFAOYSA-N |
Boiling Point: | 252.4 °C at 760 mmHg |
Melting Point: | 108-110 °C |
Purity: | 95 % |
Density: | 2.671 g/cm3 |
Appearance: | White powder or crystals |
MDL: | MFCD00001055 |
LogP: | 3.45220 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112374965-A | Halogen bond eutectic material and preparation method and application thereof | 20201117 |
CN-111334292-A | Triblock multi-color luminescent organic micro-nano crystal and preparation and application thereof | 20200416 |
CN-111394093-A | One-dimensional core-shell triblock multi-color luminescent organic micro-nano crystal and preparation and application thereof | 20200416 |
CN-112110789-A | Synthetic method of 2,2',3,3',5,5',6,6' -octafluoro-4-halobiphenyl | 20200108 |
CN-113087590-A | Synthetic method of 2,2',3,3',5,5',6,6' -octafluorobiphenyl | 20200108 |
PMID | Publication Date | Title | Journal |
22511542 | 20120529 | Quantifying homo- and heteromolecular hydrogen bonds as a guide for adduct formation | Chemistry (Weinheim an der Bergstrasse, Germany) |
22590313 | 20120501 | 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 |
22353010 | 20120315 | Energetic effects between halogen bonds and anion-π or lone pair-π interactions: a theoretical study | The journal of physical chemistry. A |
21180747 | 20110307 | Observation of a two-dimensional halogen-bonded cocrystal at sub-monolayer coverage using synchrotron X-ray diffraction | Chemical communications (Cambridge, England) |
21589066 | 20101023 | 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 |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 401.80256 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 401.80256 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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