1,3-Diiodopropane - CAS 627-31-6
Catalog: |
BB031764 |
Product Name: |
1,3-Diiodopropane |
CAS: |
627-31-6 |
Synonyms: |
1,3-diiodopropane |
IUPAC Name: | 1,3-diiodopropane |
Description: | 1,3-Diiodopropane (CAS# 627-31-6) is a useful research chemical. A reagent used in the preparation of synthetically challenging bridged achiral 1,2,4,5-tetraoxanes with antimalarial properties. |
Molecular Weight: | 295.89 |
Molecular Formula: | C3H6I2 |
Canonical SMILES: | C(CI)CI |
InChI: | InChI=1S/C3H6I2/c4-2-1-3-5/h1-3H2 |
InChI Key: | AAAXMNYUNVCMCJ-UHFFFAOYSA-N |
Boiling Point: | 111-113 °C (31 mmHg) |
Density: | 2.576 g/cm3 |
Appearance: | Light brown-yellow liquid, darkening with exposure to light |
LogP: | 2.24650 |
Vapor Pressure: | 0.26 [mmHg] |
GHS Hazard Statement: | H315 (94%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112877072-A | Long-acting agriculture and forestry water-retaining agent and preparation method thereof | 20210114 |
CN-112933255-A | Radionuclide-loaded iodine oil preparation and preparation method and application thereof | 20201217 |
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CN-112299965-A | Tetraphenyl ethylene-based material and method for detecting temperature and organic solvent steam | 20200924 |
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PMID | Publication Date | Title | Journal |
22324813 | 20120322 | One- and two-dimensional translational energy distributions in the iodine-loss dissociation of 1,2-C2H4I2+ and 1,3-C3H6I2+: what does this mean? | The journal of physical chemistry. A |
19701186 | 20091001 | Redesigning dehalogenase access tunnels as a strategy for degrading an anthropogenic substrate | Nature chemical biology |
18243702 | 20080301 | An efficient route into synthetically challenging bridged achiral 1,2,4,5-tetraoxanes with antimalarial activity | Bioorganic & medicinal chemistry letters |
16800585 | 20060629 | The surface chemistry of propylene, 1-iodopropane, and 1,3-diiodopropane on MoAl alloy thin films formed on dehydroxylated alumina | The journal of physical chemistry. B |
Complexity: | 12.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 295.85590 |
Formal Charge: | 0 |
Heavy Atom Count: | 5 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 295.85590 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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