3-(Bromomethyl)-8-quinolinol 8-Acetate - CAS 187334-19-6
Catalog: |
BB061990 |
Product Name: |
3-(Bromomethyl)-8-quinolinol 8-Acetate |
CAS: |
187334-19-6 |
Synonyms: |
3-(Bromomethyl)-8-quinolinol Acetate |
IUPAC Name: | [3-(bromomethyl)quinolin-8-yl] acetate |
Description: | 3-(Bromomethyl)-8-quinolinol 8-Acetate is an intermediate in the synthesis of metal-ion chelating amino acid into proteins as a biophysical probe. |
Molecular Weight: | 280.12 |
Molecular Formula: | C12H10BrNO2 |
Canonical SMILES: | CC(=O)OC1=CC=CC2=CC(=CN=C21)CBr |
InChI: | InChI=1S/C12H10BrNO2/c1-8(15)16-11-4-2-3-10-5-9(6-13)7-14-12(10)11/h2-5,7H,6H2,1H3 |
InChI Key: | NGSBOJRWPLTSMJ-UHFFFAOYSA-N |
Melting Point: | >110º (dec.) |
Solubility: | DMSO (Slightly), Methanol (Slightly) |
Appearance: | Yellow Solid |
Storage: | 4°C, Hygroscopic |
References: | Albrecht, M., et al. Synthesis., 2, 213 (1997). |
Complexity: | 259 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 278.98949 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 278.98949 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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