3-Fluoroiodobenzene - CAS 1121-86-4
Catalog: |
BB002896 |
Product Name: |
3-Fluoroiodobenzene |
CAS: |
1121-86-4 |
Synonyms: |
1-fluoro-3-iodobenzene |
IUPAC Name: | 1-fluoro-3-iodobenzene |
Description: | 3-Fluoroiodobenzene (CAS# 1121-86-4) is a useful research chemical. |
Molecular Weight: | 222.00 |
Molecular Formula: | C6H4FI |
Canonical SMILES: | C1=CC(=CC(=C1)I)F |
InChI: | InChI=1S/C6H4FI/c7-5-2-1-3-6(8)4-5/h1-4H |
InChI Key: | VSKSBSORLCDRHS-UHFFFAOYSA-N |
Boiling Point: | 77-78 °C (19 mmHg) |
Purity: | 98 % |
Density: | 1.89 g/cm3 |
Appearance: | Clear yellow or pink liquid |
Storage: | Keep in dark place, Sealed in dry, Room Temperature |
MDL: | MFCD00001044 |
LogP: | 2.43030 |
GHS Hazard Statement: | H315 (100%): 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 |
WO-2021123294-A1 | Oga inhibitor compounds | 20191218 |
WO-2021113698-A1 | Masp-2 inhibitors and methods of use | 20191204 |
WO-2021102288-A1 | Pyridopyrimidinone derivatives as ahr antagonists | 20191122 |
WO-2021097240-A1 | Compounds and uses thereof | 20191113 |
EP-3819300-A1 | Biomarker-based therapeutic composition | 20190906 |
PMID | Publication Date | Title | Journal |
18454143 | 20080601 | Gene expression signatures and small-molecule compounds link a protein kinase to Plasmodium falciparum motility | Nature chemical biology |
Complexity: | 74.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.93418 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.93418 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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