2-Chloro-4-nitro-6-(trifluoromethyl)aniline - CAS 400-67-9
Catalog: |
BB024279 |
Product Name: |
2-Chloro-4-nitro-6-(trifluoromethyl)aniline |
CAS: |
400-67-9 |
Synonyms: |
2-chloro-4-nitro-6-(trifluoromethyl)aniline; 2-chloro-4-nitro-6-(trifluoromethyl)aniline |
IUPAC Name: | 2-chloro-4-nitro-6-(trifluoromethyl)aniline |
Description: | 2-Chloro-4-nitro-6-(trifluoromethyl)aniline (CAS# 400-67-9) is a useful intermediate for the preparation of monoazo dyes. |
Molecular Weight: | 240.57 |
Molecular Formula: | C7H4ClF3N2O2 |
Canonical SMILES: | C1=C(C=C(C(=C1Cl)N)C(F)(F)F)[N+](=O)[O-] |
InChI: | InChI=1S/C7H4ClF3N2O2/c8-5-2-3(13(14)15)1-4(6(5)12)7(9,10)11/h1-2H,12H2 |
InChI Key: | MFJODFSUXHFZJR-UHFFFAOYSA-N |
Boiling Point: | 286 °C at 760 mmHg |
Density: | 1.614 g/cm3 |
LogP: | 3.95360 |
Publication Number | Title | Priority Date |
JP-5048479-B2 | Disperse dye, disperse dye composition, ink for ink-jet printing, dyeing method and dyed material using these | 20051116 |
JP-WO2007058209-A1 | Disperse dye, disperse dye composition, ink for ink-jet printing, dyeing method and dyed material using these | 20051116 |
KR-100949416-B1 | Disperse Dyes, Disperse Dye Compositions, Inkjet Printing Inks, Dyeing Methods and Dyes | 20051116 |
KR-20080053952-A | Disperse Dyes, Disperse Dye Compositions, Inkjet Printing Inks, Dyeing Methods and Dyes | 20051116 |
AU-2005284501-A1 | Substituted aniline derivatives | 20040913 |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.9913396 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.9913396 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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