4-Iodobenzoyl chloride - CAS 1711-02-0
Catalog: |
BB012716 |
Product Name: |
4-Iodobenzoyl chloride |
CAS: |
1711-02-0 |
Synonyms: |
4-iodobenzoyl chloride |
IUPAC Name: | 4-iodobenzoyl chloride |
Description: | 4-Iodobenzoyl chloride (CAS# 1711-02-0) is a useful research chemical. |
Molecular Weight: | 266.46 |
Molecular Formula: | C7H4ClIO |
Canonical SMILES: | C1=CC(=CC=C1C(=O)Cl)I |
InChI: | InChI=1S/C7H4ClIO/c8-7(10)5-1-3-6(9)4-2-5/h1-4H |
InChI Key: | NJAKCIUOTIPYED-UHFFFAOYSA-N |
Boiling Point: | 120-121 °C (1 mmHg) |
Melting Point: | 63-65 °C |
Purity: | 95 % |
Density: | 1.932 g/cm3 |
Appearance: | Light yellow to beige crystalline powder |
MDL: | MFCD00001058 |
LogP: | 2.67020 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
22074181 | 20111222 | Synthesis and properties of molecular probes for the rescue site on mutant cystic fibrosis transmembrane conductance regulator | Journal of medicinal chemistry |
20657050 | 20100820 | Synthesis and characterization of novel radiopaque poly(allyl amine) nanoparticles | Nanotechnology |
19618939 | 20090813 | Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography | Journal of medicinal chemistry |
18047286 | 20080101 | Synthesis and characterization of radiopaque iodine-containing degradable PVA hydrogels | Biomacromolecules |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.89954 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.89954 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4 |
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