4-Fluoro-2-(pentan-2-yloxy)aniline - CAS 1373233-19-2
Catalog: |
BB056105 |
Product Name: |
4-Fluoro-2-(pentan-2-yloxy)aniline |
CAS: |
1373233-19-2 |
Synonyms: |
4-Fluoro-2-(pentan-2-yloxy)aniline; 4-fluoro-2-pentan-2-yloxyaniline; Benzenamine, 4-fluoro-2-(1-methylbutoxy)- |
IUPAC Name: | 4-fluoro-2-pentan-2-yloxyaniline |
Description: | 4-Fluoro-2-(pentan-2-yloxy)aniline |
Molecular Weight: | 197.25 |
Molecular Formula: | C11H16FNO |
Canonical SMILES: | CCCC(C)OC1=C(C=CC(=C1)F)N |
InChI: | InChI=1S/C11H16FNO/c1-3-4-8(2)14-11-7-9(12)5-6-10(11)13/h5-8H,3-4,13H2,1-2H3 |
InChI Key: | CQSPAZIVKBYORP-UHFFFAOYSA-N |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.121592296 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.121592296 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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