4-Iodo-2-(trifluoromethyl)aniline - CAS 97760-97-9
Catalog: |
BB042069 |
Product Name: |
4-Iodo-2-(trifluoromethyl)aniline |
CAS: |
97760-97-9 |
Synonyms: |
4-iodo-2-(trifluoromethyl)aniline; 4-iodo-2-(trifluoromethyl)aniline |
IUPAC Name: | 4-iodo-2-(trifluoromethyl)aniline |
Description: | 4-Iodo-2-(trifluoromethyl)aniline (CAS# 97760-97-9) is a useful research chemical. |
Molecular Weight: | 287.02 |
Molecular Formula: | C7H5F3IN |
Canonical SMILES: | C1=CC(=C(C=C1I)C(F)(F)F)N |
InChI: | InChI=1S/C7H5F3IN/c8-7(9,10)5-3-4(11)1-2-6(5)12/h1-3H,12H2 |
InChI Key: | MAJKZNONEQIIGP-UHFFFAOYSA-N |
Boiling Point: | 261.9 °C at 760 mmHg |
Density: | 1.948 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD04972657 |
LogP: | 3.47340 |
Publication Number | Title | Priority Date |
US-10633542-B2 | Azacyanine dyes and use thereof | 20180321 |
US-2019292371-A1 | Azacyanine dyes and use thereof | 20180321 |
US-2021040326-A1 | Azacyanine dyes and use thereof | 20180321 |
AU-2018319016-A1 | AHR inhibitors and uses thereof | 20170817 |
CA-3073051-A1 | Ahr inhibitors and uses thereof | 20170817 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 286.94188 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 286.94188 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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