2-Methyl-4-(2,2,2-trifluoroethoxy)aniline hydrochloride - CAS 1431962-93-4
Catalog: |
BB053187 |
Product Name: |
2-Methyl-4-(2,2,2-trifluoroethoxy)aniline hydrochloride |
CAS: |
1431962-93-4 |
Synonyms: |
2-Methyl-4-(2,2,2-trifluoroethoxy)anilinehydrochloride |
IUPAC Name: | 2-methyl-4-(2,2,2-trifluoroethoxy)aniline;hydrochloride |
Molecular Weight: | 241.64 |
Molecular Formula: | C9H11ClF3NO |
Canonical SMILES: | CC1=C(C=CC(=C1)OCC(F)(F)F)N.Cl |
InChI: | InChI=1S/C9H10F3NO.ClH/c1-6-4-7(2-3-8(6)13)14-5-9(10,11)12;/h2-4H,5,13H2,1H3;1H |
InChI Key: | WTVFAMCWTKVENI-UHFFFAOYSA-N |
Appearance: | Solid |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.0481262 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.0481262 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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