2,6-Diiodophenol - CAS 28177-54-0
Catalog: |
BB055832 |
Product Name: |
2,6-Diiodophenol |
CAS: |
28177-54-0 |
Synonyms: |
2,6-diiodophenol; 2,6-diiodphenol |
IUPAC Name: | 2,6-diiodophenol |
Description: | 2,6-Diiodophenol is a useful reactant in organic synthesis. |
Molecular Weight: | 345.9 |
Molecular Formula: | C6H4I2O |
Canonical SMILES: | C1=CC(=C(C(=C1)I)O)I |
InChI: | InChI=1S/C6H4I2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H |
InChI Key: | VMGBDTCTVUUNAO-UHFFFAOYSA-N |
Melting Point: | 67-69°C |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless to White Solid |
Storage: | Amber Vial, -20°C Freezer, Under inert atmosphere |
References: | Gebara, Karimi S., et al. Tetrahedron Let., 52(22), 2849-2852 (2011);Lv, Chunjie, et al. Org. Let., 20(7), 1919-1923 (2018). |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22095646 | 20111216 | Remarkably selective recognition of iodobenzene derivatives by a macrocyclic bis-Pt(II) metallohost | Chemistry (Weinheim an der Bergstrasse, Germany) |
Complexity: | 87.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 345.83516 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 345.83516 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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