4-(2-Bromoethyl)-2-fluoroanisole - CAS 404-89-7
Catalog: |
BB024526 |
Product Name: |
4-(2-Bromoethyl)-2-fluoroanisole |
CAS: |
404-89-7 |
Synonyms: |
4-(2-bromoethyl)-2-fluoro-1-methoxybenzene; 4-(2-bromoethyl)-2-fluoro-1-methoxybenzene |
IUPAC Name: | 4-(2-bromoethyl)-2-fluoro-1-methoxybenzene |
Description: | 4-(2-Bromoethyl)-2-fluoroanisole (CAS# 404-89-7 ) is a useful research chemical. |
Molecular Weight: | 233.08 |
Molecular Formula: | C9H10BrFO |
Canonical SMILES: | COC1=C(C=C(C=C1)CCBr)F |
InChI: | InChI=1S/C9H10BrFO/c1-12-9-3-2-7(4-5-10)6-8(9)11/h2-3,6H,4-5H2,1H3 |
InChI Key: | XZVCZATZZWKEQJ-UHFFFAOYSA-N |
LogP: | 2.77170 |
Publication Number | Title | Priority Date |
AU-2012280420-B2 | 1, 2, 4 -thiadiazol- 5 -ylpiperazine derivatives useful in the treatment neurodegenerative diseases | 20110701 |
CA-2837247-A1 | 1 , 2 , 4 -thiadiazol- 5 -ylpiperazine derivatives useful in the treatment neurodegenerative diseases | 20110701 |
EP-2726470-A1 | 1, 2, 4 -thiadiazol- 5 -ylpiperazine derivatives useful in the treatment neurodegenerative diseases | 20110701 |
EP-2726470-B1 | 1,2,4-thiadiazol-5-ylpiperazine derivatives useful in the treatment of neurodegenerative diseases | 20110701 |
JP-2014518240-A | 1,2,4-thiadiazol-5-ylpiperazine derivatives useful for the treatment of neurodegenerative diseases | 20110701 |
Complexity: | 132 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.98991 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.98991 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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