| CAS Number | 660848-57-7 |
| Catalog Number | AG003A3N(AGN-PC-03QCJS) |
| Chemical Name | 2-Methoxy-5-(trifluoromethoxy)aniline |
| IUPAC Name | 2-methoxy-5-(trifluoromethoxy)aniline |
| InChI | InChI=1S/C8H8F3NO2/c1-13-7-3-2-5(4-6(7)12)14-8(9,10)11/h2-4H,12H2,1H3 |
| InChI Key | MKAPTOAKEPIGOA-UHFFFAOYSA-N |
| MDL Number | MFCD09832305 |
| Molecular Formula | C8H8F3NO2 |
| Molecular Weight | 207.1498 |
| SMILES | COC1=C(N)C=C(C=C1)OC(F)(F)F |
| Synonyms | 2-METHOXY-5-(TRIFLUOROMETHOXY)ANILINE,
660848-57-7,
MFCD09832305,
SCHEMBL5114311,
CTK7A6584,
KS-00003TI3,
2-Amino-4-(trifluoromethoxy)anisole,
SBB093816,
ZINC38529721,
AKOS015956668,
FCH1325570,
2-methoxy-5-(trifluoromethoxy)phenylamine,
PC303041,
TS-02958,
CS-0061911,
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| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.152g/mol |
| Monoisotopic Mass | 207.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number