4-(3-Methoxyphenyl)aniline - CAS 207287-79-4
Catalog: |
BB016226 |
Product Name: |
4-(3-Methoxyphenyl)aniline |
CAS: |
207287-79-4 |
Synonyms: |
4-(3-methoxyphenyl)aniline; 4-(3-methoxyphenyl)aniline |
IUPAC Name: | 4-(3-methoxyphenyl)aniline |
Description: | 4-(3-Methoxyphenyl)aniline (CAS# 207287-79-4) is a useful research chemical. |
Molecular Weight: | 199.25 |
Molecular Formula: | C13H13NO |
Canonical SMILES: | COC1=CC=CC(=C1)C2=CC=C(C=C2)N |
InChI: | InChI=1S/C13H13NO/c1-15-13-4-2-3-11(9-13)10-5-7-12(14)8-6-10/h2-9H,14H2,1H3 |
InChI Key: | OSWFIVFLDKOXQC-UHFFFAOYSA-N |
Boiling Point: | 340.3 °C at 760 mmHg |
Density: | 1.1 g/cm3 |
MDL: | MFCD03424684 |
LogP: | 4.32760 |
Publication Number | Title | Priority Date |
WO-2019234405-A1 | Compounds useful in the treatment of disorders associated with mutant ras | 20180604 |
EP-3802492-A1 | Compounds useful in the treatment of disorders associated with mutant ras | 20180604 |
US-2021214322-A1 | Compounds useful in the treatment of disorders associated with mutant ras | 20180604 |
AU-2011249546-A1 | Novel immunomodulator and anti inflammatory compounds | 20100506 |
AU-2011249546-B2 | Novel immunomodulator and anti inflammatory compounds | 20100506 |
PMID | Publication Date | Title | Journal |
22465507 | 20120601 | Pharmacokinetics and tissue distribution study of scoparone in rats by ultraperformance liquid-chromatography with tandem high-definition mass spectrometry | Fitoterapia |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.099714038 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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