3-Fluoro-2-iodoanisole - CAS 7079-54-1
Catalog: |
BB034236 |
Product Name: |
3-Fluoro-2-iodoanisole |
CAS: |
7079-54-1 |
Synonyms: |
1-fluoro-2-iodo-3-methoxybenzene |
IUPAC Name: | 1-fluoro-2-iodo-3-methoxybenzene |
Description: | 3-Fluoro-2-iodoanisole (CAS# 7079-54-1) is a useful research chemical. |
Molecular Weight: | 252.02 |
Molecular Formula: | C7H6FIO |
Canonical SMILES: | COC1=C(C(=CC=C1)F)I |
InChI: | InChI=1S/C7H6FIO/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3 |
InChI Key: | CPTMVKLYWHEOMG-UHFFFAOYSA-N |
Boiling Point: | 225.3 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.8 g/cm3 |
MDL: | MFCD03788539 |
LogP: | 2.43890 |
GHS Hazard Statement: | H301 (97.5%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P310, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-10280164-B2 | Pyrazolopyridone compounds and uses thereof | 20160909 |
US-2018072719-A1 | Pyrazolopyridone compounds and uses thereof | 20160909 |
WO-2018049191-A1 | Pyrazolopyridone derivatives as hpk1 modulators and uses thereof for the treatment of cancer | 20160909 |
WO-2014131315-A1 | Bridged ring compounds as hepatitis c virus inhibitors, pharmaceutical compositions and uses thereof | 20130227 |
US-2015079028-A1 | Bridged Ring compounds As Hepatitis C Virus (HCV) Inhibitors And Pharmaceutical Applications Thereof | 20120803 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 251.94474 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 251.94474 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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