2-Methyl-4-(trifluoromethoxy)iodobenzene - CAS 886763-05-9
Catalog: |
BB039144 |
Product Name: |
2-Methyl-4-(trifluoromethoxy)iodobenzene |
CAS: |
886763-05-9 |
Synonyms: |
1-iodo-2-methyl-4-(trifluoromethoxy)benzene |
IUPAC Name: | 1-iodo-2-methyl-4-(trifluoromethoxy)benzene |
Description: | 2-Methyl-4-(trifluoromethoxy)iodobenzene (CAS# 886763-05-9) is a useful research chemical compound. |
Molecular Weight: | 302.03 |
Molecular Formula: | C8H6F3IO |
Canonical SMILES: | CC1=C(C=CC(=C1)OC(F)(F)F)I |
InChI: | InChI=1S/C8H6F3IO/c1-5-4-6(2-3-7(5)12)13-8(9,10)11/h2-4H,1H3 |
InChI Key: | YLCOLVIMVHKUKE-UHFFFAOYSA-N |
Boiling Point: | 219.7 °C at 760 mmHg |
Density: | 1.795 g/cm3 |
MDL: | MFCD07368714 |
LogP: | 3.49820 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021047622-A1 | Pyridine oxynitride, preparation method therefor and use thereof | 20190912 |
CA-2954784-A1 | Antiproliferative compounds and methods of use thereof | 20140711 |
CN-106660991-B | Antiproliferative compounds and methods of use thereof | 20140711 |
CN-111170991-A | Antiproliferative compounds and methods of synthesis thereof | 20140711 |
EA-033633-B1 | ANTIPROLIFERATIVE COMPOUNDS AND WAYS OF THEIR APPLICATION | 20140711 |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 301.94155 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 301.94155 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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