3-[4-Fluoro-3-(trifluoromethyl)phenyl]aniline hydrochloride - CAS 1373232-65-5
Catalog: |
BB065095 |
Product Name: |
3-[4-Fluoro-3-(trifluoromethyl)phenyl]aniline hydrochloride |
CAS: |
1373232-65-5 |
Synonyms: |
3-[4-Fluoro-3-(trifluoromethyl)phenyl]aniline, HCl; 3-[4-Fluoro-3-(trifluoromethyl)phenyl]aniline hydrochloride; 3-[4-fluoro-3-(trifluoromethyl)phenyl]aniline; hydrochloride; 3-[4-Fluoro-3-(trifluoromethyl)phenyl]aniline HCl |
IUPAC Name: | 3-[4-fluoro-3-(trifluoromethyl)phenyl]anilinehydrochloride |
Description: | 3-[4-Fluoro-3-(trifluoromethyl)phenyl]aniline, HCl |
Molecular Weight: | 291.67 |
Molecular Formula: | C13H10ClF4N |
Canonical SMILES: | C1=CC(=CC(=C1)N)C2=CC(=C(C=C2)F)C(F)(F)F.Cl |
InChI: | InChI=1S/C13H9F4N.ClH/c14-12-5-4-9(7-11(12)13(15,16)17)8-2-1-3-10(18)6-8/h1-7H,18H21H |
InChI Key: | XKWXAYVIPJOYBB-UHFFFAOYSA-N |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 291.0437897 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 291.0437897 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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