2,4-Difluoro-5-(trifluoromethoxy)aniline - CAS 123572-59-8
Catalog: |
BB005724 |
Product Name: |
2,4-Difluoro-5-(trifluoromethoxy)aniline |
CAS: |
123572-59-8 |
Synonyms: |
2,4-difluoro-5-(trifluoromethoxy)aniline; 2,4-difluoro-5-(trifluoromethoxy)aniline |
IUPAC Name: | 2,4-difluoro-5-(trifluoromethoxy)aniline |
Description: | 2,4-Difluoro-5-(trifluoromethoxy)aniline (CAS# 123572-59-8) is a useful research chemical. |
Molecular Weight: | 213.10 |
Molecular Formula: | C7H4F5NO |
Canonical SMILES: | C1=C(C(=CC(=C1OC(F)(F)F)F)F)N |
InChI: | InChI=1S/C7H4F5NO/c8-3-1-4(9)6(2-5(3)13)14-7(10,11)12/h1-2H,13H2 |
InChI Key: | YDLIEJPIFDOQSD-UHFFFAOYSA-N |
Boiling Point: | 198.5 ℃ at 760 mmHg |
Density: | 1.516 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 ℃ |
LogP: | 3.02680 |
Publication Number | Title | Priority Date |
CN-113061142-A | Heterocyclic compounds with programmed cell necrosis pathway inhibition activity and application thereof | 20200102 |
JP-2003238541-A | Isothiazolylaminocarbonyl-containing compounds and their use as pesticides | 20011214 |
WO-03051123-A1 | Isothiazolylaminocarbonyl derivatives as pesticides | 20011214 |
DE-3737983-A1 | 3-CYANO-4-PHENYL-PYRROL DERIVATIVES | 19871109 |
DE-3737985-A1 | FLUORINE-FLUORINE AND FLUOROMETHYLTHIO-AMINOBENZOLS CONTAINING FLUOR ON THE AROMATIC CORE AND THE PRODUCTION THEREOF | 19871109 |
Complexity: | 197 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.02130456 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.02130456 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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