2-Iodophenol - CAS 533-58-4
Catalog: |
BB028172 |
Product Name: |
2-Iodophenol |
CAS: |
533-58-4 |
Synonyms: |
2-iodophenol |
IUPAC Name: | 2-iodophenol |
Description: | 2-Iodophenol (CAS# 533-58-4) is a halophenol with antifungal activity. 2-Iodophenol is used as a catalyst in the synthesis of 1,3,5-substituted benzenes. 2-Iodophenol is also used as additive tracers for resist plasma etching. |
Molecular Weight: | 220.01 |
Molecular Formula: | C6H5IO |
Canonical SMILES: | C1=CC=C(C(=C1)O)I |
InChI: | InChI=1S/C6H5IO/c7-5-3-1-2-4-6(5)8/h1-4,8H |
InChI Key: | KQDJTBPASNJQFQ-UHFFFAOYSA-N |
Boiling Point: | 186-187 °C (160 mmHg) |
Purity: | 98 % |
Density: | 1.947 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00013963 |
LogP: | 1.99680 |
Vapor Pressure: | 0.00616 [mmHg] |
GHS Hazard Statement: | H302 (87.23%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113264944-A | Organic compound, organic electroluminescent material and device thereof | 20210514 |
CN-113200812-A | Synthesis method of 1,3, 5-trisubstituted aryl compound | 20210427 |
CN-113307726-A | Preparation method and application of propyne aryl ether compound | 20210427 |
CN-113121619-A | Method for catalyzing phenolic hydroxyl glycosylation by organic thiourea | 20210420 |
CN-113214283-A | Preparation method of furan macrocyclic compound, prepared furan macrocyclic compound and application | 20210412 |
PMID | Publication Date | Title | Journal |
24463645 | 20140303 | Synthesis, structure-activity relationship of iodinated-4-aryloxymethyl-coumarins as potential anti-cancer and anti-mycobacterial agents | European journal of medicinal chemistry |
22095646 | 20111216 | Remarkably selective recognition of iodobenzene derivatives by a macrocyclic bis-Pt(II) metallohost | Chemistry (Weinheim an der Bergstrasse, Germany) |
21988411 | 20111104 | A new insight into palladium-catalyzed reaction of 2-alkynylphenol with carbon monoxide | Organic letters |
21916477 | 20111021 | Regioselective synthesis of 1,3,5-substituted benzenes via the InCl(3)/2-iodophenol-catalyzed cyclotrimerization of alkynes | The Journal of organic chemistry |
21677940 | 20110807 | Pd-carbene catalyzed carbonylation reactions of aryl iodides | Dalton transactions (Cambridge, England : 2003) |
Complexity: | 74.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.93851 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.93851 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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