4-(4-Aminophenyl)-1-methylpyridin-1-ium Iodide - CAS 118931-23-0
Catalog: |
BB061405 |
Product Name: |
4-(4-Aminophenyl)-1-methylpyridin-1-ium Iodide |
CAS: |
118931-23-0 |
Synonyms: |
4-(4-AMINOPHENYL)-1-METHYLPYRIDIN-1-IUM IODIDE; 4-(1-methylpyridin-1-ium-4-yl)aniline; iodide; 4-(4-AMINOPHENYL)-1-METHYLPYRIDIN-1-IUMIODIDE |
IUPAC Name: | 4-(1-methylpyridin-1-ium-4-yl)anilineiodide |
Description: | 4-(4-Aminophenyl)-1-methylpyridin-1-ium iodide |
Molecular Weight: | 312.15 |
Molecular Formula: | C12H13IN2 |
Canonical SMILES: | C[N+]1=CC=C(C=C1)C2=CC=C(C=C2)N.[I-] |
InChI: | InChI=1S/C12H12N2.HI/c1-14-8-6-11(7-9-14)10-2-4-12(13)5-3-10/h2-9,13H,1H31H |
InChI Key: | AXVRCVQYSOFTSF-UHFFFAOYSA-N |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 312.01235 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 312.01235 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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